SCHEMBL1773296

SCHEMBL1773296

CN1C=Cc2cccc3cccc1c23

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NSD2 O96028 5/20 0.46
▸ ALDH1A1 P00352 9/20 0.44
▸ KDM4E B2RXH2 8/20 0.44
▸ HPGD P15428 8/20 0.44
▸ MAPT P10636 6/20 0.44
▸ GAA P10253 5/20 0.44
▸ KMT2A Q03164 5/20 0.42
▸ HSD17B10 Q99714 4/20 0.42
▸ MEN1 O00255 4/20 0.42
▸ APP P05067 1/20 0.42
▸ SNCA P37840 1/20 0.42
▸ ALOX12 P18054 1/20 0.42
▸ CASP6 P55212 1/20 0.38
▸ GFER P55789 1/20 0.38
▸ CASP1 P29466 2/20 0.37
▸ HTT P42858 1/20 0.37
▸ CASP7 P55210 1/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.36
▸ BRD4 O60885 1/20 0.36
▸ CCL2 P13500 1/20 0.36

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
SCHEMBL194315 0.80 KDM4E (0.38) NSD2ALDH1A1KDM4EHPGDMAPT
SCHEMBL4158909 0.77 KDM4E (0.49) NSD2ALDH1A1KDM4EHPGDMAPT
SCHEMBL1268568 0.76 ALDH1A1 (0.38) NSD2ALDH1A1KDM4EHPGDMAPT
SCHEMBL6510269 0.76 KDM4E (0.36) NSD2ALDH1A1KDM4EHPGDMAPT
SCHEMBL15018068 0.76 HEXA (0.41) NSD2ALDH1A1KDM4EHPGDMAPT
SCHEMBL20813226 0.74 ALDH1A1 (0.40) NSD2ALDH1A1KDM4EHPGDMAPT
SCHEMBL11797517 0.74 HEXA (0.40) NSD2ALDH1A1KDM4EHPGDMAPT
SCHEMBL8485186 0.73 KDM4E (0.34) NSD2ALDH1A1KDM4EHPGDMAPT
SCHEMBL15018655 0.72 NR1I2 (0.47) ALDH1A1KDM4EHPGDMAPTGAA
SCHEMBL15018437 0.72 HEXA (0.45) NSD2ALDH1A1KDM4EHPGDMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3542801-A1 PURIN DERIVATIVES FOR USE IN THE TREATMENT OF FAP-RELATED DISEASES Boehringer Ingelheim International GmbH (DE) 2019-09-25 — — EP claimed
US-20160136180-A1 PURIN DERIVATIVES FOR USE IN THE TREATMENT OF FAB-RELATED DISEASES BOEHRINGER INGELHEIM INT (DE) 2016-05-19 — — US claimed
WO-2013087634-A2 OXIDATIVE DYEING COMPOSITION COMPRISING A SPECIFIC PERIMIDINE COUPLER IN A MEDIUM WITH HIGH FATTY SUBSTANCE CONTENT, METHODS AND SUITABLE DEVICE L'OREAL (FR) 2013-06-20 — — WO claimed
US-20110112069-A1 PURIN DERIVATIVES FOR USE IN THE TREATMENT OF FAB-RELATED DISEASES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-05-12 — — US claimed
US-10844065-B2 Heterocyclic compound, and organic electroluminescence device and organic electroluminescence display device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2020-11-24 — — US disclosed
EP-3542801-A1 PURIN DERIVATIVES FOR USE IN THE TREATMENT OF FAP-RELATED DISEASES Boehringer Ingelheim International GmbH (DE) 2019-09-25 — — EP disclosed
EP-2190434-B1 PURIN DERIVATIVES FOR USE IN THE TREATMENT OF FAP-RELATED DISEASES BOEHRINGER INGELHEIM INT (DE) 2019-04-17 — — EP disclosed
US-20190084986-A1 HETEROCYCLIC COMPOUND, AND ORGANIC ELECTROLUMINESCENCE DEVICE AND ORGANIC ELECTROLUMINESCENCE DISPLAY DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2019-03-21 — — US disclosed
EP-1306131-B1 Cross-coupling process using a catalyst comprising a cyclic nitrogen ligand SUMITOMO CHEMICAL CO (JP) 2016-12-07 — — EP disclosed
US-20160136180-A1 PURIN DERIVATIVES FOR USE IN THE TREATMENT OF FAB-RELATED DISEASES BOEHRINGER INGELHEIM INT (DE) 2016-05-19 — — US disclosed
WO-2013087634-A2 OXIDATIVE DYEING COMPOSITION COMPRISING A SPECIFIC PERIMIDINE COUPLER IN A MEDIUM WITH HIGH FATTY SUBSTANCE CONTENT, METHODS AND SUITABLE DEVICE L'OREAL (FR) 2013-06-20 — — WO disclosed
US-20110112069-A1 PURIN DERIVATIVES FOR USE IN THE TREATMENT OF FAB-RELATED DISEASES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-05-12 — — US disclosed
US-20030162950-A1 Coupling catalyst and process using the same SUMITOMO CHEMICAL COMPANY, LIMITED 2003-08-28 — — US disclosed
EP-1306131-A2 Cross-Coupling catalyst comprising a cyclic nitrogen ligand and process using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-05-02 — — EP disclosed
EP-0985674-B1 ORGANIC COMPOUNDS CONTAINING SILICON OR GERMANIUM, TRANSITION METAL COMPLEXES, CATALYST FOR ALPHA-OLEFIN POLYMERIZATION, AND PROCESSES FOR PRODUCING ALPHA-OLEFIN POLYMERS MITSUBISHI CHEM CORP (JP) 2003-04-23 — — EP disclosed
US-6255515-B1 COORDINATION POLYMERIZATION CATALYSTS MITSUBISHI CHEMICAL CORPORATION (JP) 2001-07-03 — — US disclosed
EP-0985674-A1 ORGANIC COMPOUNDS CONTAINING SILICON OR GERMANIUM, TRANSITION METAL COMPLEXES, CATALYST FOR $g(a)-OLEFIN POLYMERIZATION, AND PROCESSES FOR PRODUCING $g(a)-OLEFIN POLYMERS MITSUBISHI CHEMICAL CORPORATION (JP) 2000-03-15 — — EP disclosed
US-5922086-A OXIDATION COLOR DYES FOR HAIR WITH PERMIDINE COUPLERS AND DEVELOPERS CLARIANT GMBH (DE) 1999-07-13 — — US disclosed
EP-0822804-A1 HAIR COLORANTS BASED ON PERIMIDINE DERIVATIVES Clariant GmbH (DE) 1998-02-11 — — EP disclosed
WO-1996033692-A1 HAIR COLORANTS BASED ON PERIMIDINE DERIVATIVES CLARIANT GMBH (DE) 1996-10-31 — — 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 (5 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-20030162950-A1 Coupling catalyst and process using the same NOD1, PYM1, C9 NSD2 817/4885ALDH1A1 3293/4885KDM4E 3633/4885
US-10844065-B2 Heterocyclic compound, and organic electroluminescence device and organic electroluminescence display device including the same CCND2, CCND1, ODC1 NSD2 286/4885ALDH1A1 13/4885KDM4E 3336/4885
US-20190084986-A1 HETEROCYCLIC COMPOUND, AND ORGANIC ELECTROLUMINESCENCE DEVICE AND ORGANIC ELECTROLUMINESCENCE DISPLAY DEVICE INCLUDING THE SAME CCND2, CCND1, ODC1 NSD2 286/4885ALDH1A1 13/4885KDM4E 3336/4885
US-20160136180-A1 PURIN DERIVATIVES FOR USE IN THE TREATMENT OF FAB-RELATED DISEASES PNP, ENTPD5, NUDT14 NSD2 1355/4885ALDH1A1 3607/4885KDM4E 3292/4885
US-20110112069-A1 PURIN DERIVATIVES FOR USE IN THE TREATMENT OF FAB-RELATED DISEASES PNP, PURB, NUDT14 NSD2 841/4885ALDH1A1 3774/4885KDM4E 2873/4885

“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.

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