SCHEMBL7965854

SCHEMBL7965854

Fc1cc(OCC=C(Cl)Cl)cc(Cl)c1OCCCNc1ccc(C(F)(F)F)cc1

nearest known ligand 0.35

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.35
RHOC P08134 3/20 0.34
RHOA P61586 3/20 0.34
SCN9A Q15858 2/20 0.33
SIGMAR1 Q99720 1/20 0.32
SCN8A Q9UQD0 1/20 0.32
CACNA1B Q00975 3/20 0.32
JAK1 P23458 1/20 0.32
BLK P51451 1/20 0.32
JAK3 P52333 1/20 0.32
THRB P10828 1/20 0.30
CACNA1H O95180 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
SCHEMBL7982119 0.97 HTT (0.34) HTTRHOCRHOASCN9ASIGMAR1
SCHEMBL8408424 0.94 HTT (0.38) HTTRHOCRHOASCN9ASIGMAR1
SCHEMBL8659999 0.91 HTT (0.37) HTTRHOCRHOASCN9ASIGMAR1
SCHEMBL7979272 0.89 HTT (0.38) HTTRHOCRHOASIGMAR1
SCHEMBL7979390 0.89 SCN8A (0.38) HTTRHOCRHOASCN9ASCN8A
SCHEMBL7965701 0.86 HTT (0.37) HTTRHOCRHOASIGMAR1
SCHEMBL7965856 0.86 RHOC (0.48) HTTRHOCRHOAJAK1BLK
SCHEMBL7976122 0.86 HTT (0.36) HTTRHOCRHOASCN9ASCN8A
SCHEMBL7979247 0.85 HTT (0.38) HTTRHOCRHOASCN9ASIGMAR1
SCHEMBL7979279 0.85 MAPT (0.36) HTTRHOCRHOASCN9ASCN8A

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-6214835-B1 CONTROLLING INSECTS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-04-10 US disclosed