SCHEMBL11048258

SCHEMBL11048258

C=C(C(=O)O)c1[nH]c2ccccc2c1Cc1cccnc1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FNTA P49354 7/20 0.51
FNTB P49356 7/20 0.51
KDM4E B2RXH2 2/20 0.43
ALDH1A1 P00352 2/20 0.43
VKORC1 Q9BQB6 1/20 0.43
PKM P14618 1/20 0.42
MAPK10 P53779 1/20 0.42
IDO1 P14902 2/20 0.41
PARP14 Q460N5 1/20 0.41
NAPRT Q6XQN6 1/20 0.40

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
SCHEMBL10806686 0.78 FNTA (0.45) FNTAFNTBKDM4EALDH1A1MAPK10
SCHEMBL11049470 0.76 TAAR1 (0.43) KDM4EALDH1A1
SCHEMBL11048261 0.75 TBXAS1 (0.54) FNTAFNTBVKORC1PKMMAPK10
SCHEMBL10806849 0.74 ATM (0.54) KDM4EALDH1A1
SCHEMBL8582781 0.74 TBXAS1 (0.39) KDM4EIDO1NAPRT
SCHEMBL6756295 0.73 KDM4E (0.65) KDM4EALDH1A1
SCHEMBL11049461 0.73 TBXAS1 (0.57)
SCHEMBL11037967 0.71 FNTA (0.47) FNTAFNTBKDM4EVKORC1PKM
SCHEMBL6341806 0.71 TBXAS1 (0.54) FNTAFNTBVKORC1PKMMAPK10
SCHEMBL7745979 0.71 KDM4E (0.57) KDM4EALDH1A1

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-4451472-A ANTITHROMBOSIS AND ANTIISCHEMIC AGENTS, AND TREATMENT OF VASCULAR COMPLICATIONS OF DIAMETES PFIZER INC. (US) 1984-05-29 US disclosed
US-4451472-A ANTITHROMBOSIS AND ANTIISCHEMIC AGENTS, AND TREATMENT OF VASCULAR COMPLICATIONS OF DIAMETES PFIZER INC. (US) 1984-05-29 US disclosed