SCHEMBL8005970

SCHEMBL8005970

CC(C)(NCc1ccccc1Cl)C(=O)Nc1ccc(N)c(C(F)(F)F)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNJ5 P48544 3/20 0.55
KCNJ3 P48549 3/20 0.55
AR P10275 1/20 0.55
TRPV1 Q8NER1 5/20 0.47
ALDH1A1 P00352 2/20 0.44
MEN1 O00255 1/20 0.44
LMNA P02545 1/20 0.44
MAPT P10636 1/20 0.44
KMT2A Q03164 1/20 0.44
KDR P35968 1/20 0.44
CYP3A4 P08684 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
CNR2 P34972 1/20 0.42
KCNJ6 P48051 1/20 0.42
CASR P41180 1/20 0.41
HPGD P15428 2/20 0.40
POLB P06746 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40

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
SCHEMBL8024028 0.87 AR (0.57) KCNJ5KCNJ3ARALDH1A1MEN1
SCHEMBL8006346 0.84 AR (0.47) KCNJ5KCNJ3ARALDH1A1MEN1
SCHEMBL14295894 0.82 AR (0.49) KCNJ5KCNJ3ARTRPV1ALDH1A1
SCHEMBL14300662 0.80 AR (0.47) ARTRPV1
SCHEMBL14300661 0.76 AR (0.41) KCNJ5KCNJ3ARALDH1A1MEN1
SCHEMBL2031406 0.75 AR (0.71) ARMAPTKDRCYP3A4CNR2
SCHEMBL8021006 0.75 AR (0.48) ARMEN1LMNAMAPTKMT2A
SCHEMBL8024928 0.74 AR (0.48) ARKDR
SCHEMBL12584028 0.72 AR (0.56) AR
SCHEMBL14295896 0.71 MEN1 (0.39) KCNJ5KCNJ3ARMEN1LMNA

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