SCHEMBL17414712

SCHEMBL17414712

OCc1ccc(CCl)cc1F

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 1/20 0.33
EGFR P00533 1/20 0.33
CYP4F2 P78329 1/20 0.33
CYP4A11 Q02928 1/20 0.33
CA2 P00918 3/20 0.32
CA1 P00915 2/20 0.32
GPR52 Q9Y2T5 1/20 0.32
MEN1 O00255 1/20 0.32
MAPT P10636 1/20 0.32
KMT2A Q03164 1/20 0.32
TTR P02766 1/20 0.31
HTT P42858 1/20 0.31
IDO1 P14902 1/20 0.31
AGXT P21549 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
SCHEMBL522479 0.85 EGFR (0.43) KIF11EGFRCYP4F2CYP4A11CA2
SCHEMBL28204423 0.85 TTR (0.34) CA2CA1MEN1MAPTKMT2A
SCHEMBL27860196 0.83 CYP4F2 (0.43) KIF11EGFRCYP4F2CYP4A11MEN1
SCHEMBL2601933 0.80 CA1 (0.35) EGFRCA2CA1MEN1MAPT
SCHEMBL8771711 0.79 TRPA1 (0.43) KIF11CYP4F2CYP4A11
SCHEMBL505918 0.79 HTT (0.38) KIF11EGFRCYP4F2CYP4A11CA2
SCHEMBL18562850 0.79 LOXL2 (0.43) IDO1AGXT
SCHEMBL18068667 0.77 MEN1 (0.50) GPR52MEN1MAPTKMT2A
SCHEMBL27930482 0.76 TDP1 (0.35) KIF11EGFRCYP4F2CYP4A11CA2
SCHEMBL29489387 0.75 HTT (0.45) TTRHTT

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-20160003040-A1 Tracers Resman Technology AS (NO) 2016-01-07 US disclosed