SCHEMBL11633688

SCHEMBL11633688

Clc1ccc(C2OCC(OCc3ccccc3)CO2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 1/20 0.40
CTSL P07711 1/20 0.40
CTSB P07858 1/20 0.40
CTSK P43235 1/20 0.40
BCHE P06276 2/20 0.39
MAPK1 P28482 1/20 0.38
SLC6A4 P31645 2/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
SLC6A2 P23975 1/20 0.38
SLC6A3 Q01959 1/20 0.38
GRM5 P41594 1/20 0.38
KDM1A O60341 1/20 0.38
RCOR1 Q9UKL0 1/20 0.38
GPBAR1 Q8TDU6 1/20 0.37
DPP4 P27487 1/20 0.37
OPRM1 P35372 1/20 0.37
OPRL1 P41146 1/20 0.37

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
SCHEMBL11633685 1.00 KCNA5 (0.40) KCNA5CTSLCTSBCTSKBCHE
SCHEMBL11634478 0.94 MEN1 (0.42) CTSLCTSBCTSKBCHEL3MBTL1
SCHEMBL11634473 0.94 MEN1 (0.42) CTSLCTSBCTSKBCHEL3MBTL1
SCHEMBL11637675 0.89 CTSL (0.45) CTSLCTSBCTSKBCHEL3MBTL1
SCHEMBL1560842 0.89 CTSL (0.45) CTSLCTSBCTSKBCHEL3MBTL1
SCHEMBL11635684 0.89 CTSL (0.45) CTSLCTSBCTSKBCHEL3MBTL1
SCHEMBL11633476 0.87 CTSL (0.39) CTSLCTSBCTSKBCHESLC6A4
SCHEMBL11633482 0.87 CTSL (0.39) CTSLCTSBCTSKBCHESLC6A4
SCHEMBL11632580 0.85 BCHE (0.40) CTSLCTSBCTSKBCHESLC6A4
SCHEMBL11635432 0.85 CARM1 (0.44) SLC6A4CARM1PRMT6

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