SCHEMBL11635429

SCHEMBL11635429

Clc1cccc(CO[C@H]2CO[C@@H](c3ccccc3)OC2)c1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CARM1 Q86X55 1/20 0.44
PRMT6 Q96LA8 1/20 0.44
CYP3A4 P08684 2/20 0.43
IDO1 P14902 2/20 0.43
AGXT P21549 2/20 0.43
TACR1 P25103 3/20 0.42
SIGMAR1 Q99720 1/20 0.40
SLC6A4 P31645 1/20 0.39
HTR6 P50406 1/20 0.39
MAOA P21397 2/20 0.39
MAOB P27338 2/20 0.39
DRD2 P14416 1/20 0.39
DRD3 P35462 1/20 0.39
KCNH2 Q12809 1/20 0.39
NAAA Q02083 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
SCHEMBL11635432 1.00 CARM1 (0.44) CARM1PRMT6CYP3A4IDO1AGXT
SCHEMBL11632585 0.92 BCHE (0.40) CARM1PRMT6CYP3A4IDO1AGXT
SCHEMBL11632580 0.92 BCHE (0.40) CARM1PRMT6CYP3A4IDO1AGXT
SCHEMBL11637675 0.85 CTSL (0.45) CARM1PRMT6SIGMAR1NAAA
SCHEMBL11635684 0.85 CTSL (0.45) CARM1PRMT6SIGMAR1NAAA
SCHEMBL1560842 0.85 CTSL (0.45) CARM1PRMT6SIGMAR1NAAA
SCHEMBL11633685 0.85 KCNA5 (0.40) CARM1PRMT6SLC6A4
SCHEMBL11633688 0.85 KCNA5 (0.40) CARM1PRMT6SLC6A4
SCHEMBL11634473 0.85 MEN1 (0.42) CARM1PRMT6CYP3A4IDO1AGXT
SCHEMBL11634478 0.85 MEN1 (0.42) CARM1PRMT6CYP3A4IDO1AGXT

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