SCHEMBL1930692

SCHEMBL1930692

C=Cc1ccccc1CNC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 8/20 0.41
SLC6A2 P23975 6/20 0.41
SLC6A3 Q01959 6/20 0.41
LTA4H P09960 1/20 0.41
ALDH1A1 P00352 3/20 0.40
KDM4E B2RXH2 1/20 0.40
CYP3A4 P08684 1/20 0.40
MAPT P10636 1/20 0.40
HTR2A P28223 3/20 0.39
IFNAR1 P17181 1/20 0.39
MCL1 Q07820 1/20 0.38
PKM P14618 1/20 0.37
KCNH2 Q12809 1/20 0.36
MEN1 O00255 1/20 0.36
POLB P06746 1/20 0.36
KMT2A Q03164 1/20 0.36
CYP2D6 P10635 1/20 0.34
TSHR P16473 1/20 0.34
HIF1A Q16665 1/20 0.34
TAAR1 Q96RJ0 1/20 0.34

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
Hydrochloric Acid SCHEMBL10445033 0.98 KDM4E (0.43) SLC6A4SLC6A2SLC6A3LTA4HALDH1A1
Methylethylamine SCHEMBL4595057 0.80 ALDH1A1 (0.38) SLC6A4SLC6A2SLC6A3ALDH1A1CYP3A4
SCHEMBL8749936 0.80 TSHR (0.45) SLC6A4SLC6A2SLC6A3ALDH1A1KDM4E
SCHEMBL7741253 0.80 ALDH1A1 (0.38) SLC6A4SLC6A2ALDH1A1KDM4EKCNH2
SCHEMBL23252534 0.80 TAAR1 (0.53) SLC6A2ALDH1A1KDM4ECYP3A4HTR2A
SCHEMBL50299 0.80 ALDH1A1 (0.48) ALDH1A1MEN1KMT2ATSHR
SCHEMBL16299849 0.79 SLC6A4 (0.41) SLC6A4SLC6A2SLC6A3LTA4HALDH1A1
Dimethylamine SCHEMBL8062717 0.79 ALDH1A1 (0.40) ALDH1A1MAPTKCNH2KMT2A
SCHEMBL27380622 0.79 LMNA (0.48) SLC6A4SLC6A2SLC6A3LTA4HALDH1A1
SCHEMBL11032962 0.79 MEN1 (0.40) LTA4HALDH1A1KDM4EMAPTPKM

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 20 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1984035-A2 MEDICAL DEVICES HAVING TEXTURED SURFACES Medtronic, Inc. (US) 2008-10-29 EP claimed
US-20070225785-A1 MEDICAL DEVICES HAVING TEXTURED SURFACES MEDTRONIC, INC. (US) 2007-09-27 US claimed
WO-2007095549-A2 MEDICAL DEVICES HAVING TEXTURED SURFACES MEDTRONIC, INC. (US) 2007-08-23 WO claimed
US-20230365594-A1 THIENOPYRROLE COMPOUNDS GILEAD SCIENCES, INC. 2023-11-16 US disclosed
US-11661431-B2 Thienopyrrole compounds GILEAD SCIENCES, INC. (US) 2023-05-30 US disclosed
WO-2023004266-A1 IMMUNOCONJUGATES AND METHODS RECURIUM IP HOLDINGS, LLC (US) 2023-01-26 WO disclosed
US-20220389034-A1 THIENOPYRROLE COMPOUNDS GILEAD SCIENCES, INC. 2022-12-08 US disclosed
WO-2017102784-A9 ISOINDOLE COMPOUNDS ASTRAZENECA AB (SE) 2018-04-05 WO disclosed
WO-2017185324-A1 GROUP 8 TRANSITION METAL CATALYSTS AND METHOD FOR MAKING SAME AND PROCESS FOR USE OF SAME IN OLEFIN DISPROPORTIONATION REACTIONS XIA, LING (CN) 2017-11-02 WO disclosed
WO-2017102784-A1 ISOINDOLE COMPOUNDS ASTRAZENECA AB (SE) 2017-06-22 WO disclosed
US-9206167-B2 Piperazine-substituted benzothiophenes for treatment of mental disorders OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2015-12-08 US disclosed
US-20140163039-A1 PIPERAZINE-SUBSTITUTED BENZOTHIOPHENES FOR TREATMENT OF MENTAL DISORDERS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2014-06-12 US disclosed
US-7955512-B2 Medical devices having textured surfaces MEDTRONIC, INC. (US) 2011-06-07 US disclosed
WO-2010148381-A2 GROUP IV OLEFIN POLYMERIZATION CATALYSTS AND POLYMERIZATION METHODS CORNELL UNIVERSITY (US) 2010-12-23 WO disclosed
EP-1984035-A2 MEDICAL DEVICES HAVING TEXTURED SURFACES Medtronic, Inc. (US) 2008-10-29 EP disclosed
US-20070225785-A1 MEDICAL DEVICES HAVING TEXTURED SURFACES MEDTRONIC, INC. (US) 2007-09-27 US disclosed
WO-2007095549-A2 MEDICAL DEVICES HAVING TEXTURED SURFACES MEDTRONIC, INC. (US) 2007-08-23 WO disclosed
EP-0389928-A2 Electrophotographic light-sensitive material FUJI PHOTO FILM CO., LTD. (JP) 1990-10-03 EP disclosed
US-4734351-A DISPERSION OF POLYMER FUJI PHOTO FILM CO., LTD. (JP) 1988-03-29 US disclosed
EP-0091039-A2 Anti-fouling agent Nitto Kasei Co., Ltd. (JP) 1983-10-12 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 (4 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-20230365594-A1 THIENOPYRROLE COMPOUNDS SSB, TPMT, LCP2 SLC6A4 2687/4885SLC6A2 2341/4885SLC6A3 2578/4885
US-20140163039-A1 PIPERAZINE-SUBSTITUTED BENZOTHIOPHENES FOR TREATMENT OF MENTAL DISORDERS GRIN2C, TPH1, HTR2C SLC6A4 41/4885SLC6A2 94/4885SLC6A3 27/4885
US-11661431-B2 Thienopyrrole compounds SSB, TPMT, LCP2 SLC6A4 2687/4885SLC6A2 2341/4885SLC6A3 2578/4885
US-20220389034-A1 THIENOPYRROLE COMPOUNDS SSB, TPMT, LCP2 SLC6A4 2687/4885SLC6A2 2341/4885SLC6A3 2578/4885

“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.