SCHEMBL6287419

SCHEMBL6287419

Cc1ccc2c(CC(=O)O)c[nH]c2c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.58
ALDH1A1 P00352 4/20 0.56
TSHR P16473 2/20 0.56
HPGD P15428 2/20 0.56
NPSR1 Q6W5P4 2/20 0.56
LMNA P02545 1/20 0.56
GLA P06280 1/20 0.56
CYP2C9 P11712 1/20 0.56
NFKB1 P19838 1/20 0.56
PMP22 Q01453 1/20 0.56
KDM4E B2RXH2 4/20 0.55
MPL P40238 1/20 0.53
MAPT P10636 5/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
ALOX15 P16050 1/20 0.51
NR4A2 P43354 1/20 0.51
ICMT O60725 2/20 0.49
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
GAA P10253 2/20 0.49

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4626532 0.88 ALDH1A1 (0.63) HTR2AALDH1A1TSHRHPGDNPSR1
SCHEMBL6116786 0.87 TSHR (0.69) HTR2AALDH1A1TSHRHPGDNPSR1
SCHEMBL25139531 0.87 HTR2A (0.58) HTR2AALDH1A1HPGDNPSR1LMNA
SCHEMBL10123846 0.86 ICMT (0.66) HTR2ANPSR1LMNAMAPTNR4A2
SCHEMBL23701747 0.84 ICMT (0.64) HTR2AALDH1A1TSHRHPGDNPSR1
SCHEMBL20119825 0.84 HTR2A (0.63) HTR2AHPGDNPSR1MAPTSMN1; SMN2
SCHEMBL25139540 0.84 HTR2A (0.55) HTR2AALDH1A1HPGDNPSR1LMNA
SCHEMBL14564356 0.83 NR4A2 (0.58) HTR2AALDH1A1HPGDNPSR1LMNA
SCHEMBL6663269 0.82 ALDH1A1 (0.77) HTR2AALDH1A1TSHRHPGDNPSR1
SCHEMBL14823139 0.82 PKM (0.70) HTR2AALDH1A1LMNACYP2C9KDM4E

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3438108-B1 PHENYL [A]INDOLE[2,3-G]QUINOLIZINE COMPOUNDS, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION, AND APPLICATIONS THEREOF SHANGHAI INST MATERIA MEDICA CAS (CN) 2022-08-10 EP disclosed
CN-109071541-B Phenyl [ a ] indole [2,3-g ] quinolizine compound, preparation method thereof, pharmaceutical composition and application thereof 中国科学院上海药物研究所 2021-06-18 CN disclosed
US-10927107-B2 Phenyl [a]indole[2,3-g]quinolizine compounds, preparation method therefor, pharmaceutical composition, and applications thereof SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) 2021-02-23 US disclosed
US-20200216435-A1 BICYCLIC HETEROAROMATIC AMIDE COMPOUNDS FOR USE IN THERAPY EUROPEAN MOLECULAR BIOLOGY LABORATORY (DE) 2020-07-09 US disclosed
US-20200216435-A1 BICYCLIC HETEROAROMATIC AMIDE COMPOUNDS FOR USE IN THERAPY EUROPEAN MOLECULAR BIOLOGY LABORATORY (DE) 2020-07-09 US disclosed
EP-3638667-A1 BICYCLIC HETEROAROMATIC AMIDE COMPOUNDS FOR USE IN THERAPY European Molecular Biology Laboratory (DE) 2020-04-22 EP disclosed
CN-111032653-A Bicyclic heteroaromatic amide compounds for therapy 欧洲分子生物学实验室 2020-04-17 CN disclosed
US-20190194185-A1 PHENYL [A]INDOLE[2,3-G]QUINOLIZINE COMPOUNDS, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION, AND APPLICATIONS THEREOF SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) 2019-06-27 US disclosed
EP-3438108-A1 PHENYL [A]INDOLE[2,3-G]QUINOLIZINE COMPOUNDS, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION, AND APPLICATIONS THEREOF Shanghai Institute of Materia Medica, Chinese Academy of Sciences (CN) 2019-02-06 EP disclosed
CN-109071541-A Phenyl [ a ] indole [2,3-g ] quinolizine compound, preparation method thereof, pharmaceutical composition and application thereof 中国科学院上海药物研究所 2018-12-21 CN disclosed
US-20150051405-A1 NEW 1,2,4-OXADIAZOL DERIVATIVES, PROCESS FOR THEIR PREPARATION AND USE THEREOF AS INTERMEDIATES IN THE PREPARATION OF INDOLIC ALKALOIDS CONSIGLIO NAZIONALE DELLE RICERCHE (IT) 2015-02-19 US disclosed
CN-103347874-B dimeric IAP inhibitors NOVARTIS AG (CH) 2014-10-29 CN disclosed
CN-103347874-A Dimeric iap inhibitors NOVARTIS AG 2013-10-09 CN disclosed
US-8470786-B2 Pyrroloquinolinyl-pyrrolidine-2,5-dione compositions and methods for preparing and using same ARQULE, INC. (US) 2013-06-25 US disclosed
US-20120165278-A1 Pyrroloquinolinyl-Pyrrolidine-2,5-Dione Compositions And Methods For Preparing And Using Same ARQULE, INC. (US) 2012-06-28 US disclosed
US-20070054902-A1 Isoxazole derivatives as peroxisome proliferator-activated receptors agonists SHIONOGI & CO., LTD. (JP) 2007-03-08 US disclosed
US-20070054902-A1 Isoxazole derivatives as peroxisome proliferator-activated receptors agonists SHIONOGI & CO., LTD. (JP) 2007-03-08 US disclosed
US-6887890-B2 Compounds exhibiting thrombopoietin-like activities CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2005-05-03 US disclosed
US-20030162724-A1 Compounds exhibiting thrombopoietin-like activities CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2003-08-28 US disclosed
EP-1291341-A1 COMPOUNDS EXHIBITING THROMBOPOIETIN-LIKE ACTIVITIES CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2003-03-12 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (7 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10927107-B2 Phenyl [a]indole[2,3-g]quinolizine compounds, preparation method therefor, pharmaceutical composition, and applications thereof PCSK9, PCSK7, PCSK6 HTR2A 414/4885ALDH1A1 2606/4885TSHR 3140/4885
US-20200216435-A1 BICYCLIC HETEROAROMATIC AMIDE COMPOUNDS FOR USE IN THERAPY NR5A1, NR3C2, NR3C1 HTR2A 1170/4885ALDH1A1 2444/4885TSHR 1638/4885
US-20150051405-A1 NEW 1,2,4-OXADIAZOL DERIVATIVES, PROCESS FOR THEIR PREPARATION AND USE THEREOF AS INTERMEDIATES IN THE PREPARATION OF INDOLIC ALKALOIDS IDO1, ADRA1D, PNMT HTR2A 129/4885ALDH1A1 1777/4885TSHR 4058/4885
US-20030162724-A1 Compounds exhibiting thrombopoietin-like activities MPL, THPO, TEK HTR2A 799/4885ALDH1A1 2042/4885TSHR 435/4885
US-20190194185-A1 PHENYL [A]INDOLE[2,3-G]QUINOLIZINE COMPOUNDS, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION, AND APPLICATIONS THEREOF PCSK9, PCSK7, PCSK6 HTR2A 414/4885ALDH1A1 2606/4885TSHR 3140/4885
US-20120165278-A1 Pyrroloquinolinyl-Pyrrolidine-2,5-Dione Compositions And Methods For Preparing And Using Same DHPS, PDCD5, DPYD HTR2A 3245/4885ALDH1A1 1136/4885TSHR 4565/4885
US-20070054902-A1 Isoxazole derivatives as peroxisome proliferator-activated receptors agonists NR1H3, NR1H2, RXRA HTR2A 3396/4885ALDH1A1 1698/4885TSHR 176/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.