SCHEMBL4574649

SCHEMBL4574649

Clc1cccc(CNC2CC3CNCC3C2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CARM1 Q86X55 2/20 0.50
PRMT6 Q96LA8 2/20 0.50
MAPT P10636 1/20 0.45
ALOX12 P18054 1/20 0.45
CHRM2 P08172 1/20 0.43
PNMT P11086 1/20 0.42
TACR1 P25103 1/20 0.42
SLC6A4 P31645 2/20 0.41
HTR6 P50406 2/20 0.41
RXFP1 Q9HBX9 1/20 0.40
HTR2C P28335 1/20 0.40
HTR2B P41595 1/20 0.40
NOS1 P29475 2/20 0.39
NOS3 P29474 1/20 0.39
GABRP O00591 1/20 0.39
GABRD O14764 1/20 0.39
GABRA1 P14867 1/20 0.39
GABRB1 P18505 1/20 0.39
GABRG2 P18507 1/20 0.39
GABRB3 P28472 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
SCHEMBL10039743 0.81 GRIN2B (0.50) CARM1PRMT6
SCHEMBL64031 0.79 CARM1 (0.63) CARM1PRMT6MAPTALOX12CHRM2
SCHEMBL4586847 0.79 CARM1 (0.56) CARM1PRMT6MAPTALOX12CHRM2
SCHEMBL4495643 0.79 RXFP1 (0.48) CARM1PRMT6MAPTALOX12RXFP1
SCHEMBL4495638 0.79 RXFP1 (0.48) CARM1PRMT6MAPTALOX12RXFP1
Hydrochloric Acid SCHEMBL21879607 0.78 CARM1 (0.62) CARM1PRMT6MAPTALOX12CHRM2
SCHEMBL9667976 0.76 POLB (0.62) CARM1PRMT6MAPTALOX12CHRM2
SCHEMBL20557084 0.73 KDM1A (0.50) CHRM2TACR1SLC6A4
SCHEMBL21094339 0.73 KDM1A (0.50) CHRM2TACR1SLC6A4
SCHEMBL20557083 0.73 KDM1A (0.50) CHRM2TACR1SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008065500-A2 HETEROARYL AMIDES AS TYPE I GLYCINE TRANSPORT INHIBITORS PFIZER PRODUCTS INC. (US) 2008-06-05 WO disclosed