SCHEMBL11632580

SCHEMBL11632580

Clc1cccc([C@H]2OC[C@@H](OCc3ccccc3)CO2)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCHE P06276 1/20 0.40
CARM1 Q86X55 1/20 0.39
PRMT6 Q96LA8 1/20 0.39
DRD2 P14416 1/20 0.39
DRD3 P35462 1/20 0.39
KCNH2 Q12809 1/20 0.39
CTSL P07711 1/20 0.38
CTSB P07858 1/20 0.38
CTSK P43235 1/20 0.38
GRIN1 Q05586 1/20 0.38
GRIN2B Q13224 1/20 0.38
CCR5 P51681 1/20 0.37
TACR1 P25103 1/20 0.37
SLC6A4 P31645 1/20 0.37
SIGMAR1 Q99720 1/20 0.37
GRM5 P41594 1/20 0.37
CYP3A4 P08684 1/20 0.36
IDO1 P14902 1/20 0.36
AGXT P21549 1/20 0.36
TAAR1 Q96RJ0 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
SCHEMBL11632585 1.00 BCHE (0.40) BCHECARM1PRMT6DRD2DRD3
SCHEMBL11635429 0.92 CARM1 (0.44) CARM1PRMT6DRD2DRD3KCNH2
SCHEMBL11635432 0.92 CARM1 (0.44) CARM1PRMT6DRD2DRD3KCNH2
SCHEMBL11633482 0.89 CTSL (0.39) BCHECARM1PRMT6CTSLCTSB
SCHEMBL11633476 0.89 CTSL (0.39) BCHECARM1PRMT6CTSLCTSB
SCHEMBL11637675 0.85 CTSL (0.45) BCHECARM1PRMT6CTSLCTSB
SCHEMBL11635684 0.85 CTSL (0.45) BCHECARM1PRMT6CTSLCTSB
SCHEMBL1560842 0.85 CTSL (0.45) BCHECARM1PRMT6CTSLCTSB
SCHEMBL11634473 0.85 MEN1 (0.42) BCHECARM1PRMT6CTSLCTSB
SCHEMBL11634478 0.85 MEN1 (0.42) BCHECARM1PRMT6CTSLCTSB

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-4077982-A HERBICIDES FMC CORPORATION (US) 1978-03-07 US claimed
US-4077982-A HERBICIDES FMC CORPORATION (US) 1978-03-07 US disclosed