SCHEMBL8083764

SCHEMBL8083764

COC(=O)Nc1cc(OC2CCCCC2)c(Cl)cc1F

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 7/20 0.54
TSHR P16473 1/20 0.45
PDE4D Q08499 8/20 0.45
PDE4A P27815 6/20 0.45
PDE4B Q07343 6/20 0.45
PDE4C Q08493 6/20 0.45
PPOX P50336 1/20 0.44
RORC P51449 1/20 0.42
LMNA P02545 1/20 0.42
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL7931893 0.99 SCN9A (0.52) SCN9ATSHRPDE4DPDE4APDE4B
SCHEMBL7922423 0.87 SCN9A (0.48) SCN9ATSHRPDE4DPDE4APDE4B
SCHEMBL8089641 0.84 RORC (0.40) SCN9ATSHRRORCLMNASMN1; SMN2
SCHEMBL8191955 0.84 SCN9A (0.46) SCN9ATSHRPDE4DPDE4APDE4B
SCHEMBL9260247 0.82 POLB (0.45) SCN9APDE4DPDE4APDE4BPDE4C
SCHEMBL9262674 0.82 SCN9A (0.41) SCN9ATSHRLMNASMN1; SMN2
SCHEMBL8998045 0.82 SCN9A (0.42) SCN9ATSHRPDE4DPDE4APDE4B
SCHEMBL8763572 0.80 NPSR1 (0.51) SCN9APDE4DPDE4APDE4BPDE4C
SCHEMBL8083691 0.80 NPC1 (0.44) SCN9APDE4DPDE4APDE4BPDE4C
SCHEMBL30296512 0.80 SCN9A (0.48) SCN9APDE4DPDE4BPPOXRORC

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 9 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-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
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
US-5391807-A Methods of preparing fluorobenzene derivatives and related compounds SAGAMI CHEMICAL RESEARCH CENTER (JP) 1995-02-21 US disclosed
US-5344953-A Fluorobenzene derivatives SAGAMI CHEMICAL RESEARCH CENTER (JP) 1994-09-06 US disclosed
US-5281742-A Bis(fluorophenyl) carbonate derivatives SAGAMI CHEMICAL RESEARCH CENTER (JP) 1994-01-25 US disclosed
EP-0496347-A2 Methods of preparing fluorobenzene derivatives and related compounds SAGAMI CHEMICAL RESEARCH CENTER (JP) 1992-07-29 EP 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