SCHEMBL8076457

SCHEMBL8076457

CC1CCCC1Oc1cc(N)c(F)cc1Cl

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 1/20 0.39
CARM1 Q86X55 2/20 0.38
PRMT1 Q99873 2/20 0.38
SCN9A Q15858 12/20 0.35
F2 P00734 3/20 0.35
F10 P00742 3/20 0.35
PLG P00747 3/20 0.35
PLAU P00749 3/20 0.35
PLAT P00750 3/20 0.35
PPOX P50336 1/20 0.33
NPC1 O15118 1/20 0.33
SCN5A Q14524 1/20 0.33

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
SCHEMBL7683050 0.77 CSNK2A1 (0.49) SCN9APPOXNPC1
SCHEMBL8599165 0.77 CSNK2A1 (0.41) SCN9APPOXNPC1
SCHEMBL8088011 0.76 SCN9A (0.48) MCHR1CARM1PRMT1SCN9APPOX
Hydrochloric Acid SCHEMBL8369025 0.76 CSNK2A1 (0.50) CARM1PRMT1SCN9APPOXNPC1
SCHEMBL9262674 0.75 SCN9A (0.41) SCN9ASCN5A
SCHEMBL8084589 0.74 MCHR1 (0.41) MCHR1SCN9APPOXNPC1
SCHEMBL8084392 0.73 PPOX (0.47) PPOX
SCHEMBL9562757 0.70 KMO (0.36) SCN9APPOXNPC1
SCHEMBL8602953 0.70 NPC1 (0.42) NPC1
SCHEMBL1224878 0.69 NPC1 (0.67) PPOXNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0493606-B1 HETEROCYCLE-SUBSTITUTED BENZENE DERIVATIVE, PRODUCTION THEREOF, AND HERBICIDE CONTAINING THE SAME AS ACTIVE INGREDIENT SAGAMI CHEM RES (JP) 2000-10-18 EP disclosed
EP-1006105-A1 Benzene derivatives SAGAMI CHEMICAL RESEARCH CENTER (JP) 2000-06-07 EP disclosed
US-5639915-A Process for the production of aniline derivatives SAGAMI CHEMICAL RESEARCH CENTER (JP) 1997-06-17 US disclosed
US-5464811-A Benzene derivatives substituted with heterocyclic ring and herbicides containing same as active ingredients SAGAMI CHEMICAL RESEARCH CENTER (JP) 1995-11-07 US disclosed
EP-0659735-A1 PROCESS FOR PRODUCING ANILINE DERIVATIVE SAGAMI CHEMICAL RESEARCH CENTER (JP) 1995-06-28 EP disclosed
US-5424277-A An N-substituted-3,4,5,6-tetrahydrophthalimide derivative characterized by having a cycloalkoxy group at the 5-position of the phenyl ring on the nitrogen SAGAMI CHEMICAL RESEARCH CENTER (JP) 1995-06-13 US disclosed
EP-0493606-A1 HETEROCYCLE-SUBSTITUTED BENZENE DERIVATIVE, PRODUCTION THEREOF, AND HERBICIDE CONTAINING THE SAME AS ACTIVE INGREDIENT SAGAMI CHEMICAL RESEARCH CENTER (JP) 1992-07-08 EP disclosed