SCHEMBL9324684

SCHEMBL9324684

OCC1(c2cn(Cc3ccccc3)cn2)Cc2ccccc2C1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGDS O60760 1/20 0.40
KDM4C Q9H3R0 2/20 0.40
KDM5A P29375 1/20 0.40
KDM5B Q9UGL1 1/20 0.40
CYP3A4 P08684 2/20 0.39
CYP2D6 P10635 2/20 0.39
CYP2E1 P05181 1/20 0.39
CYP2A6 P11509 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2B6 P20813 1/20 0.39
CYP2C19 P33261 1/20 0.39
RBP4 P02753 1/20 0.38
CPB2 Q96IY4 1/20 0.37
PHF8 Q9UPP1 1/20 0.37
RIPK1 Q13546 2/20 0.36
CYP19A1 P11511 2/20 0.36
CYP11B2 P19099 2/20 0.36
CYP1A2 P05177 1/20 0.36
POLB P06746 1/20 0.36
MAPT P10636 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
SCHEMBL9325930 0.86 HPGDS (0.40) HPGDSKDM4CKDM5AKDM5BCYP3A4
SCHEMBL9325689 0.83 CYP2E1 (0.35) CYP3A4CYP2E1CYP2A6CYP2C9CYP2B6
SCHEMBL9326270 0.83 CDK5 (0.40) HPGDSKDM4CKDM5AKDM5BCYP3A4
SCHEMBL27261555 0.78 CPB2 (0.44) CPB2NPC1RAB9A
SCHEMBL27261091 0.77 HPGDS (0.39) HPGDSKDM4CKDM5AKDM5BCYP3A4
SCHEMBL9324682 0.77 TSHR (0.35) CYP2C9CYP2C19
SCHEMBL15488299 0.72 HPGDS (0.42) HPGDSKDM4CKDM5AKDM5BCYP3A4
SCHEMBL9325735 0.71 ADRA2A (0.42) CYP3A4CYP2E1CYP2A6CYP2C9CYP2B6
SCHEMBL11485374 0.69 HPGDS (0.42) HPGDSKDM4CKDM5AKDM5BCYP3A4
SCHEMBL9325707 0.69 CYP2E1 (0.35) CYP3A4CYP2E1CYP2A6CYP2C9CYP2B6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0372954-B1 Substituted imidazole derivatives and their preparation and use ORION YHTYMAE OY (FI) 1994-03-09 EP claimed
US-5292887-A Antgonists at postsynoptic adrenoreceptors; hypotensive and antidiabetic agents FARMOS-YHTYMA OY (FI) 1994-03-08 US claimed
EP-0372954-A1 Substituted imidazole derivatives and their preparation and use ORION-YHTYMÀ„ OY (FI) 1990-06-13 EP claimed
EP-0372954-B1 Substituted imidazole derivatives and their preparation and use ORION YHTYMAE OY (FI) 1994-03-09 EP disclosed
US-5292887-A Antgonists at postsynoptic adrenoreceptors; hypotensive and antidiabetic agents FARMOS-YHTYMA OY (FI) 1994-03-08 US disclosed
CN-1023219-C Substituted imidazole derivatives and their preparation and use FARMOS OY (FI) 1993-12-22 CN disclosed
EP-0372954-A1 Substituted imidazole derivatives and their preparation and use ORION-YHTYMÀ„ OY (FI) 1990-06-13 EP disclosed