SCHEMBL370013

SCHEMBL370013

CCOC(=O)c1nn(Cc2ccc(OC)cc2)cc1I

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
ALDH1A1 P00352 3/20 0.45
LMNA P02545 1/20 0.45
TARBP2 Q15633 2/20 0.44
PDE4D Q08499 1/20 0.44
PDCD4 Q53EL6 1/20 0.44
UCHL1 P09936 1/20 0.44
KDM4E B2RXH2 3/20 0.43
GABRA2 P47869 2/20 0.43
GABRB2 P47870 2/20 0.43
GLA P06280 2/20 0.43
GAA P10253 2/20 0.43
MAPK1 P28482 2/20 0.43
USP2 O75604 1/20 0.43
HPGD P15428 1/20 0.43
CASP1 P29466 1/20 0.43
CASP7 P55210 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
HSD17B10 Q99714 1/20 0.43

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
SCHEMBL369627 0.89 CACNA1G (0.45) SMN1; SMN2ALDH1A1KDM4EGLAGAA
SCHEMBL3583470 0.85 SMN1; SMN2 (0.51) MAPTSMN1; SMN2ALDH1A1LMNATARBP2
SCHEMBL370291 0.85 KMT2A (0.46) SMN1; SMN2MEN1KMT2AL3MBTL1
SCHEMBL369192 0.85 AADAT (0.44) SMN1; SMN2GAAMEN1KMT2AL3MBTL1
SCHEMBL21858188 0.83 SMN1; SMN2 (0.45) MAPTSMN1; SMN2ALDH1A1LMNATARBP2
SCHEMBL21858180 0.82 MAPT (0.43) MAPTSMN1; SMN2ALDH1A1LMNATARBP2
SCHEMBL1645500 0.81 DCTPP1 (0.47) MAPTSMN1; SMN2ALDH1A1LMNATARBP2
SCHEMBL3580396 0.81 ALDH1A1 (0.48) MAPTSMN1; SMN2ALDH1A1LMNATARBP2
SCHEMBL27163231 0.81 ALDH1A1 (0.52) MAPTALDH1A1LMNAKDM4EGABRA2
SCHEMBL365784 0.81 CACNA1G (0.43) SMN1; SMN2ALDH1A1GAATUBB4ATUBB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240239774-A1 SOLUBLE ADENYLYL CYCLASE (SAC) INHIBITORS AND USES THEREOF CORNELL UNIVERSITY (US) 2024-07-18 US disclosed
CN-117915918-A Soluble adenylate cyclase (sAC) inhibitors and uses thereof 康奈尔大学 2024-04-19 CN disclosed
EP-4329762-A1 SOLUBLE ADENYLYL CYCLASE (SAC) INHIBITORS AND USES THEREOF Cornell University (US) 2024-03-06 EP disclosed
WO-2022232259-A1 SOLUBLE ADENYLYL CYCLASE (SAC) INHIBITORS AND USES THEREOF CORNELL UNIVERSITY (US) 2022-11-03 WO disclosed
CN-111018861-B Pyrrolopyrimidine compounds 正大天晴药业集团股份有限公司 2021-11-19 CN disclosed
EP-3235819-B1 PYRROLOPYRIMIDINE COMPOUNDS USEFUL AS JAK INHIBITORS CENTAURUS BIOPHARMA CO LTD (CN) 2020-11-18 EP disclosed
CN-111018861-A Pyrrolopyrimidine compounds 正大天晴药业集团股份有限公司 2020-04-17 CN disclosed
US-10561657-B2 Pyrrolopyrimidine compound Centaurus Biophrama Co., Ltd. (CN) 2020-02-18 US disclosed
US-20190201403-A1 PYRROLOPYRIMIDINE COMPOUND LIANYUNGANG RUNZHONG PHARMACEUTICAL CO., LTD. (CN) 2019-07-04 US disclosed
EP-3235819-A1 PYRROLOPYRIMIDINE COMPOUND Centaurus BioPharma Co., Ltd. (CN) 2017-10-25 EP disclosed
US-20140349990-A1 Pyrazolopyrrolidine Derivatives and their Use in the Treatment of Disease NOVARTIS AG (CH) 2014-11-27 US disclosed
US-20140349990-A1 Pyrazolopyrrolidine Derivatives and their Use in the Treatment of Disease NOVARTIS AG (CH) 2014-11-27 US disclosed
US-20130252944-A1 NOVEL FUSED PYRAZOLE DERIVATIVES AND THEIR USE AS ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS MERCK SHARP & DOHME CORP. 2013-09-26 US disclosed
US-20130210809-A1 NOVEL 2-AMINO-4-PYRAZOLYL-THIAZOLE DERIVATIVES AND THEIR USE AS ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS BOLEA CHRISTELLE (CH) 2013-08-15 US disclosed
US-20130210807-A1 Tricyclic Compounds as Allosteric Modulators of Metabotropic Glutamate Receptors. MERCK SHARP & DOHME CORP. 2013-08-15 US disclosed
EP-2595986-A2 NOVEL 2-AMINO-4-PYRAZOLYL-THIAZOLE DERIVATIVES AND THEIR USE AS ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS Addex Pharma SA (CH) 2013-05-29 EP disclosed
EP-2593277-A2 NOVEL FUSED PYRAZOLE DERIVATIVES AND THEIR USE AS ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS ADDEX Pharma S.A. (CH) 2013-05-22 EP disclosed
WO-2012009000-A2 NOVEL FUSED PYRAZOLE DERIVATIVES AND THEIR USE AS ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS ADDEX PHARMA S.A. (CH) 2012-01-19 WO disclosed
WO-2012009009-A2 NOVEL 2-AMINO-4-PYRAZOLYL-THIAZOLE DERIVATIVES AND THEIR USE AS ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS ADDEX PHARMA S.A. (CH) 2012-01-19 WO disclosed
WO-2012008999-A2 TRICYCLIC COMPOUNDS AS ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS MERCK SHARP & DOHME CORP. (US) 2012-01-19 WO 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-20130210807-A1 Tricyclic Compounds as Allosteric Modulators of Metabotropic Glutamate Receptors. GRM3, GRM6, GRM1 MAPT 3677/4885SMN1; SMN2 3831/4885ALDH1A1 3550/4885
US-20240239774-A1 SOLUBLE ADENYLYL CYCLASE (SAC) INHIBITORS AND USES THEREOF UACA, ADCYAP1R1, ADCY1 MAPT 506/4885SMN1; SMN2 4377/4885ALDH1A1 638/4885
US-10561657-B2 Pyrrolopyrimidine compound JAK2, JAK1, JAK3 MAPT 3008/4885SMN1; SMN2 3251/4885ALDH1A1 1027/4885
US-20190201403-A1 PYRROLOPYRIMIDINE COMPOUND JAK2, JAK1, JAK3 MAPT 3008/4885SMN1; SMN2 3251/4885ALDH1A1 1027/4885
US-20130252944-A1 NOVEL FUSED PYRAZOLE DERIVATIVES AND THEIR USE AS ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS GRM4, GRM1, GRM3 MAPT 1266/4885SMN1; SMN2 2061/4885ALDH1A1 3331/4885
US-20140349990-A1 Pyrazolopyrrolidine Derivatives and their Use in the Treatment of Disease PKD1, PKD2, REN MAPT 1111/4885SMN1; SMN2 1225/4885ALDH1A1 766/4885
US-20130210809-A1 NOVEL 2-AMINO-4-PYRAZOLYL-THIAZOLE DERIVATIVES AND THEIR USE AS ALLOSTERIC MODULATORS OF METABOTROPIC GLUTAMATE RECEPTORS GRM2, GRM4, GRM1 MAPT 971/4885SMN1; SMN2 1485/4885ALDH1A1 2554/4885

“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.