SCHEMBL5745664

SCHEMBL5745664

CCCCCCc1cccc2c[c]cnc12

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KCNH2 Q12809 2/20 0.44
▸ LIPG Q9Y5X9 1/20 0.41
▸ TLR8 Q9NR97 5/20 0.39
▸ BID P55957 3/20 0.38
▸ MCL1 Q07820 3/20 0.38
▸ BCL2L1 Q07817 2/20 0.38
▸ BAK1 Q16611 2/20 0.38
▸ KAT8 Q9H7Z6 2/20 0.38
▸ PPARA Q07869 2/20 0.38
▸ PPARG P37231 1/20 0.38
▸ EP300 Q09472 1/20 0.38
▸ KAT2A Q92830 1/20 0.38
▸ KAT2B Q92831 1/20 0.38
▸ KAT5 Q92993 1/20 0.38
▸ SAE1 Q9UBE0 1/20 0.38
▸ ALOX5 P09917 1/20 0.37
▸ PTGS2 P35354 1/20 0.37
▸ MCHR1 Q99705 1/20 0.36
▸ OXER1 Q8TDS5 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
SCHEMBL5748823 1.00 KCNH2 (0.44) KCNH2LIPGTLR8BIDMCL1
SCHEMBL5747397 1.00 KCNH2 (0.44) KCNH2LIPGTLR8BIDMCL1
SCHEMBL6115046 0.78 TRPV1 (0.49) KCNH2LIPGTLR8BIDMCL1
SCHEMBL6114788 0.78 TRPV1 (0.49) KCNH2LIPGTLR8BIDMCL1
SCHEMBL6114747 0.78 TRPV1 (0.49) KCNH2LIPGTLR8BIDMCL1
SCHEMBL6115058 0.78 TRPV1 (0.49) KCNH2LIPGTLR8BIDMCL1
SCHEMBL6114571 0.78 TRPV1 (0.49) KCNH2LIPGTLR8BIDMCL1
SCHEMBL6114475 0.78 TRPV1 (0.49) KCNH2LIPGTLR8BIDMCL1
SCHEMBL6114947 0.78 TRPV1 (0.49) KCNH2LIPGTLR8BIDMCL1
SCHEMBL5745889 0.77 TLR8 (0.47) KCNH2LIPGTLR8BIDMCL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060293503-A1 Polyaminopyridines and method for producing same SUMITOMO SEIKA CHEMICALS CO., LTD (JP) 2006-12-28 — — US disclosed
EP-1669390-A1 POLYAMINOPYRIDINES AND METHOD FOR PRODUCING SAME SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) 2006-06-14 — — EP disclosed
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