SCHEMBL5322366

SCHEMBL5322366

Clc1ccc(-c2nc3ncc(-c4cccnc4)cn3c2-c2ccc(Cl)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 7/20 0.50
AKT2 P31751 7/20 0.50
CYP2A6 P11509 2/20 0.46
SLC2A1 P11166 1/20 0.45
RAB9A P51151 2/20 0.45
KDM4E B2RXH2 2/20 0.45
ALDH1A1 P00352 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
GLA P06280 1/20 0.45
GAA P10253 1/20 0.45
NPY5R Q15761 2/20 0.44
CYP3A4 P08684 1/20 0.41
CYP2C19 P33261 1/20 0.41
NPC1 O15118 1/20 0.41
MEN1 O00255 1/20 0.41
MAPK1 P28482 1/20 0.41
KMT2A Q03164 1/20 0.41
CYP19A1 P11511 2/20 0.40
RXFP1 Q9HBX9 1/20 0.39

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
SCHEMBL5344323 0.88 CYP3A4 (0.44) AKT1AKT2CYP2A6SLC2A1RAB9A
SCHEMBL5324372 0.87 AKT1 (0.55) AKT1AKT2RAB9AKDM4EALDH1A1
SCHEMBL5325683 0.84 AKT1 (0.51) AKT1AKT2RAB9AKDM4EALDH1A1
SCHEMBL5341386 0.81 AKT1 (0.49) AKT1AKT2SLC2A1RAB9AKDM4E
SCHEMBL5321323 0.81 AKT1 (0.50) AKT1AKT2SLC2A1RAB9AKDM4E
SCHEMBL5322231 0.81 AKT1 (0.48) AKT1AKT2RAB9AKDM4EALDH1A1
SCHEMBL5349048 0.81 AKT1 (0.48) AKT1AKT2RAB9AKDM4EALDH1A1
SCHEMBL5320129 0.79 AKT1 (0.46) AKT1AKT2SLC2A1RAB9AKDM4E
SCHEMBL5343647 0.79 AKT1 (0.48) AKT1AKT2RAB9AKDM4EALDH1A1
SCHEMBL5338540 0.78 AKT1 (0.46) AKT1AKT2RAB9AKDM4EALDH1A1

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
WO-2007096764-A2 BICYCLIC HETEROARYL DERIVATIVES AS CANNABINOID RECEPTOR MODULATORS GLENMARK PHARMACEUTICALS S.A. (US) 2007-08-30 WO claimed
WO-2007096764-A2 BICYCLIC HETEROARYL DERIVATIVES AS CANNABINOID RECEPTOR MODULATORS GLENMARK PHARMACEUTICALS S.A. (US) 2007-08-30 WO disclosed