SCHEMBL7976324

SCHEMBL7976324

FC(F)(F)c1ccc(NCCCCOc2c(Cl)cc(OCC=C(Br)Br)cc2Cl)cc1

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
RHOC P08134 3/20 0.35
RHOA P61586 3/20 0.35
CACNA1B Q00975 3/20 0.35
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA7 P43166 1/20 0.33
CA9 Q16790 1/20 0.33
SCN9A Q15858 1/20 0.32
EPHX2 P34913 2/20 0.31
SIGMAR1 Q99720 1/20 0.31
SCN8A Q9UQD0 1/20 0.31
CNR1 P21554 1/20 0.31
CACNA1H O95180 1/20 0.31
HDAC1 Q13547 1/20 0.31
KDM4E B2RXH2 1/20 0.31
JAK1 P23458 1/20 0.31
BLK P51451 1/20 0.31
JAK3 P52333 1/20 0.31

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
SCHEMBL7965825 0.97 RHOC (0.35) RHOCRHOACACNA1BCA1CA2
SCHEMBL8659999 0.90 HTT (0.37) RHOCRHOACACNA1BCA1CA2
SCHEMBL7982244 0.89 RHOC (0.33) RHOCRHOASIGMAR1KDM4E
SCHEMBL8408424 0.87 HTT (0.38) RHOCRHOACACNA1BSCN9ASIGMAR1
SCHEMBL7976325 0.86 RHOC (0.47) RHOCRHOACA1CA2CA7
SCHEMBL7982119 0.85 HTT (0.34) RHOCRHOACACNA1BSCN9ASIGMAR1
SCHEMBL7976122 0.84 HTT (0.36) RHOCRHOACACNA1BSCN9ASCN8A
SCHEMBL7965827 0.82 RHOC (0.50) RHOCRHOACA1CA2CA7
SCHEMBL7977794 0.82 HTT (0.37) RHOCRHOACACNA1BSCN9ASIGMAR1
SCHEMBL7979569 0.81 SCN8A (0.34) SCN8ACNR1HDAC1

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