SCHEMBL14253030

SCHEMBL14253030

COc1ccc2c([nH]c3cnccc32)c1Cl

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CHUK O15111 17/20 0.63
▸ ICOSLG O75144 3/20 0.52
▸ ICOS Q9Y6W8 3/20 0.52
▸ PRKD3 O94806 1/20 0.51
▸ PRKCG P05129 1/20 0.51
▸ PRKCB P05771 1/20 0.51
▸ PRKCA P17252 1/20 0.51
▸ CSNK2A2 P19784 1/20 0.51
▸ PRKCH P24723 1/20 0.51
▸ PRKCI P41743 1/20 0.51
▸ CSNK2B P67870 1/20 0.51
▸ CSNK2A1 P68400 1/20 0.51
▸ PRKCE Q02156 1/20 0.51
▸ PRKCQ Q04759 1/20 0.51
▸ PRKCZ Q05513 1/20 0.51
▸ PRKCD Q05655 1/20 0.51
▸ PRKD1 Q15139 1/20 0.51
▸ CYP17A1 P05093 1/20 0.45
▸ CYP19A1 P11511 1/20 0.45
▸ CYP11B1 P15538 1/20 0.45

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
SCHEMBL2768695 0.79 CHUK (0.67) CHUKICOSLGICOSDYRK1AKDM4E
SCHEMBL4818361 0.79 CHUK (0.53) CHUKICOSLGICOSPRKD3PRKCG
SCHEMBL28644669 0.78 MAPT (0.53) KDM4EGABRPGABRDALDH1A1GABRA1
SCHEMBL14253008 0.77 CHUK (1.00) CHUKICOSLGICOSDYRK1AIKBKB
SCHEMBL14253068 0.75 CHUK (0.76) CHUKICOSLGICOSDYRK1AIKBKB
SCHEMBL14253048 0.73 CHUK (0.59) CHUKICOSLGICOSPRKD3PRKCG
SCHEMBL4813555 0.71 CYP11B1 (0.58) CHUKPRKD3PRKCGPRKCBPRKCA
SCHEMBL4823698 0.71 CHUK (0.56) CHUKICOSLGICOSKDM4EGABRP
SCHEMBL14253067 0.71 CHUK (0.68) CHUKICOSLGICOSDYRK1AIKBKB
SCHEMBL14253050 0.70 CHUK (0.78) CHUKICOSLGICOSDYRK1AIKBKB

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-7348336-B2 Substituted β-carbolines SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2008-03-25 — — US disclosed
US-7348336-B2 Substituted β-carbolines SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2008-03-25 — — US disclosed
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