SCHEMBL7726091

SCHEMBL7726091

COC(=O)c1cc(-c2ccc(OC)cc2)nn(CC=Cc2ccc(F)cc2F)c1=O

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PLA2G2A P14555 6/20 0.52
▸ RAB9A P51151 2/20 0.41
▸ GABRG2 P18507 3/20 0.38
▸ GABRB3 P28472 3/20 0.38
▸ GABRA3 P34903 3/20 0.38
▸ GABRA1 P14867 2/20 0.38
▸ GABRA5 P31644 2/20 0.38
▸ GABRA2 P47869 2/20 0.38
▸ RXFP1 Q9HBX9 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ CYP2D6 P10635 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ LMNA P02545 1/20 0.37
▸ GPR139 Q6DWJ6 1/20 0.37

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
SCHEMBL7726088 1.00 PLA2G2A (0.52) PLA2G2ARAB9AGABRG2GABRB3GABRA3
SCHEMBL7723443 0.92 MAPT (0.45) PLA2G2ARAB9ARXFP1KDM4ECYP1A2
SCHEMBL7723444 0.92 MAPT (0.45) PLA2G2ARAB9ARXFP1KDM4ECYP1A2
SCHEMBL7723464 0.92 PLA2G2A (0.46) PLA2G2ARAB9ARXFP1KDM4ELMNA
SCHEMBL7723465 0.92 PLA2G2A (0.46) PLA2G2ARAB9ARXFP1KDM4ELMNA
SCHEMBL7724798 0.84 LMNA (0.42) PLA2G2ARAB9AKDM4ELMNA
SCHEMBL7724793 0.84 LMNA (0.42) PLA2G2ARAB9AKDM4ELMNA
SCHEMBL7726369 0.80 PLA2G2A (0.48) PLA2G2ARAB9ARXFP1KDM4ECYP2D6
SCHEMBL7726371 0.80 PLA2G2A (0.48) PLA2G2ARAB9ARXFP1KDM4ECYP2D6
SCHEMBL7720344 0.77 PLA2G2A (0.51) PLA2G2ARAB9AGABRG2GABRB3GABRA3

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-6403586-B1 Pyridazine derivatives and drugs containing the same as the active ingredient KOWA CO., LTD. (JP) 2002-06-11 — — US disclosed
EP-1061077-A1 NOVEL PYRIDAZINE DERIVATIVES AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT Kowa Co., Ltd. (JP) 2000-12-20 — — EP disclosed
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