SCHEMBL13746288

SCHEMBL13746288

CC(C)(NCc1ccc(F)cc1Nc1ccc(OC2CCOCC2)cc1)C(=O)Nc1ccc(F)c(C(F)(F)F)c1

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 1/20 0.38
NTRK1 P04629 1/20 0.37
AR P10275 3/20 0.37
EPHX2 P34913 5/20 0.36
RAF1 P04049 2/20 0.35
CNR2 P34972 1/20 0.35
PTK2 Q05397 1/20 0.35
P2RX4 Q99571 2/20 0.35
KDR P35968 2/20 0.35
BRAF P15056 1/20 0.35

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
SCHEMBL13745688 0.88 KMT2A (0.41) EPHX2
SCHEMBL13745415 0.81 AR (0.44) AR
SCHEMBL14295100 0.79 NTRK1 (0.44) NTRK1ARPTK2
SCHEMBL8024928 0.74 AR (0.48) ARKDR
SCHEMBL8021637 0.74 RORC (0.40) AR
SCHEMBL8015251 0.73 AR (0.46) ARKDRBRAF
SCHEMBL8005353 0.71 CNR1 (0.46) AR
SCHEMBL8018561 0.69 AR (0.47) ARRAF1P2RX4
SCHEMBL1207299 0.67 AR (0.47) AR
SCHEMBL1206917 0.66 AR (0.45) AR

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
WO-2009098000-A1 HETEROCYCLICALLY-SUBSTITUTED IMIDAZOLIDINE-2,4-DIONES, METHOD FOR THE PRODUCTION THEREOF, MEDICAMENTS CONTAINING SAID COMPOUNDS AND USE THEREOF SANOFI-AVENTIS (FR) 2009-08-13 WO disclosed