SCHEMBL8024028

SCHEMBL8024028

CC(C)(NCc1ccccc1Br)C(=O)Nc1ccc(N)c(C(F)(F)F)c1

nearest known ligand 0.57

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
AR P10275 3/20 0.57
MEN1 O00255 3/20 0.42
MAPT P10636 3/20 0.42
KMT2A Q03164 3/20 0.42
LMNA P02545 2/20 0.42
KCNJ5 P48544 2/20 0.42
KCNJ3 P48549 2/20 0.42
RIPK1 Q13546 1/20 0.41
FFAR4 Q5NUL3 2/20 0.40
PTK2 Q05397 1/20 0.38
EPHX1 P07099 2/20 0.38
FFAR1 O14842 1/20 0.38
NPC1 O15118 1/20 0.38
HTT P42858 1/20 0.38
RAB9A P51151 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
S1PR1 P21453 1/20 0.38
ALDH1A1 P00352 1/20 0.38
KCNJ6 P48051 1/20 0.38

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
SCHEMBL8005970 0.87 KCNJ5 (0.55) ARMEN1MAPTKMT2ALMNA
SCHEMBL12584028 0.85 AR (0.56) AR
SCHEMBL14295896 0.84 MEN1 (0.39) ARMEN1MAPTKMT2ALMNA
SCHEMBL14295894 0.82 AR (0.49) ARMEN1MAPTKMT2ALMNA
SCHEMBL14300662 0.82 AR (0.47) ARFFAR4FFAR1
SCHEMBL8006346 0.80 AR (0.47) ARMEN1MAPTKMT2ALMNA
SCHEMBL14300661 0.76 AR (0.41) ARMEN1MAPTKMT2ALMNA
SCHEMBL2031406 0.75 AR (0.71) ARMAPTFFAR4FFAR1NPSR1
SCHEMBL8021006 0.75 AR (0.48) ARMEN1MAPTKMT2ALMNA
SCHEMBL8024928 0.74 AR (0.48) ARS1PR1

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-2009097995-A1 NOVEL PHENYL-SUBSTITUTED IMIDAZOLIDINES, METHOD FOR THE PRODUCTION THEREOF, MEDICAMENTS CONTAINING SAID COMPOUNDS AND USE THEREOF SANOFI-AVENTIS (FR) 2009-08-13 WO disclosed