SCHEMBL7164153

SCHEMBL7164153

Cc1cc(-c2cc(OC(F)F)n(C)n2)c(F)cc1Cl

nearest known ligand 0.30

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 1/20 0.30
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL7588842 0.89 L3MBTL1 (0.32) MEN1ALDH1A1MAPTKMT2A
SCHEMBL6320670 0.80 KMO (0.36) SCN9A
SCHEMBL6284972 0.76 HSD11B1 (0.42)
SCHEMBL9095990 0.76 TRPV3 (0.35) SCN9A
SCHEMBL7160104 0.75 SLC34A1 (0.32)
SCHEMBL9097389 0.75 SCN9A (0.42) SCN9AMAPT
SCHEMBL6691871 0.75 KMT2A (0.32) KMT2A
SCHEMBL6287494 0.75 SCN9A (0.33) SCN9A
SCHEMBL7521846 0.74 ALDH1A1 (0.37) MEN1ALDH1A1MAPTKMT2A
SCHEMBL30130331 0.74 ALDH1A1 (0.37) MEN1ALDH1A1MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0879239-B1 SUBSTITUTED AROMATIC PHOSPHONIC ACID DERIVATIVES BASF AG (DE) 2003-04-23 EP disclosed
US-6175007-B1 HERBICIDES AND DEFOLIANTS BASF AKTIENGESELLSCHAFT (DE) 2001-01-16 US disclosed
US-5962694-A Substituted 1-methyl-3-phenylpyrazoles and the use thereof as herbicides and for the desiccation or defoliation of plants BASF AKTIENGESELLSCHAFT (DE) 1999-10-05 US disclosed
EP-0879239-A1 SUBSTITUTED AROMATIC PHOSPHONIC ACID DERIVATIVES BASF AKTIENGESELLSCHAFT (DE) 1998-11-25 EP disclosed
WO-1997030060-A1 SUBSTITUTED AROMATIC PHOSPHONIC ACID DERIVATIVES BASF AKTIENGESELLSCHAFT (DE) 1997-08-21 WO disclosed