SCHEMBL7508672

SCHEMBL7508672

[CH2]c1nc2ccc(Cl)cc2n1CCC

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACSS2 Q9NR19 1/20 0.45
▸ GRM5 P41594 2/20 0.45
▸ MAPT P10636 3/20 0.44
▸ PTPN1 P18031 1/20 0.40
▸ POLB P06746 2/20 0.40
▸ KMT2A Q03164 3/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ RAB9A P51151 2/20 0.39
▸ KDM4E B2RXH2 3/20 0.39
▸ GAA P10253 2/20 0.39
▸ NPSR1 Q6W5P4 2/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ GLA P06280 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ MAPK1 P28482 1/20 0.38
▸ TLR8 Q9NR97 1/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ CASP3 P42574 1/20 0.38

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
SCHEMBL7508681 0.83 KMT2A (0.57) ACSS2GRM5MAPTPTPN1KMT2A
SCHEMBL28612587 0.77 POLB (0.65) MAPTPOLBKMT2AMEN1RAB9A
SCHEMBL12598294 0.71 CYP1A2 (0.60) ACSS2MAPTPOLBTLR8
SCHEMBL13677280 0.71 ACSS2 (0.53) ACSS2MAPTPTPN1RAB9ALMNA
SCHEMBL8381210 0.71 ACSS2 (0.53) ACSS2MAPTPTPN1POLBKMT2A
SCHEMBL17876421 0.69 MAPT (0.46) ACSS2MAPTPTPN1POLBKMT2A
SCHEMBL2020767 0.69 ACSS2 (0.54) ACSS2MAPTKMT2ARAB9AKDM4E
SCHEMBL13676923 0.69 ACSS2 (0.65) ACSS2MAPT
SCHEMBL13677300 0.69 GAA (0.47) ACSS2MAPTPOLBKMT2AMEN1
SCHEMBL3969799 0.68 KMT2A (0.59) ACSS2MAPTPTPN1POLBKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2002541151-A — — 2002-12-03 — — JP claimed
EP-1165557-A1 ARYL AND HETEROARYL FUSED AMINOALKYL-IMIDAZOLE DERIVATIVES: SELECTIVE MODULATORS OF GABAa RECEPTORS NEUROGEN CORPORATION (US) 2002-01-02 — — EP claimed
WO-2000059905-A1 ARYL AND HETEROARYL FUSED AMINOALKYL-IMIDAZOLE DERIVATIVES: SELECTIVE MODULATORS OF GABAa RECEPTORS NEUROGEN CORPORATION (US) 2000-10-12 — — WO claimed
Send feedback