SCHEMBL3575452

SCHEMBL3575452

CNc1ccccc1C(=O)N(CCc1ccc(Cl)c(Cl)c1)Cc1ccc(C(C)(C)C)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
RECQL P46063 1/20 0.42
BLM P54132 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
OPRM1 P35372 1/20 0.40
OPRD1 P41143 1/20 0.40
NR1H4 Q96RI1 5/20 0.39
PPARG P37231 3/20 0.39
ESRRG P62508 3/20 0.39
ESRRB O95718 1/20 0.39
C5AR1 P21730 1/20 0.38
PPARA Q07869 2/20 0.38
NPC1 O15118 1/20 0.37
ALDH1A1 P00352 1/20 0.37
GLA P06280 1/20 0.37
RAB9A P51151 1/20 0.37
ATM Q13315 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
SIGMAR1 Q99720 1/20 0.37

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
SCHEMBL3578799 0.91 TP53 (0.39) KMT2AOPRM1OPRD1NR1H4PPARG
SCHEMBL3570707 0.91 C5AR1 (0.39) KMT2AOPRM1OPRD1NR1H4PPARG
SCHEMBL3574429 0.89 KDM4C (0.39) OPRM1OPRD1NR1H4ESRRGESRRB
SCHEMBL3579634 0.89 SERPINE1 (0.40) KMT2AMEN1NR1H4ESRRGESRRB
SCHEMBL3587595 0.89 C5AR1 (0.49) KMT2AMEN1OPRM1OPRD1NR1H4
SCHEMBL3580658 0.89 RAF1 (0.39) KMT2AMEN1OPRM1OPRD1NR1H4
SCHEMBL3571051 0.87 NR1H4 (0.37) OPRM1OPRD1NR1H4ESRRGESRRB
SCHEMBL3573203 0.85 RAF1 (0.40) KMT2AMEN1OPRM1OPRD1NR1H4
SCHEMBL3574044 0.85 NR1H4 (0.37) OPRM1OPRD1NR1H4ESRRGESRRB
SCHEMBL3582883 0.84 RAF1 (0.40) KMT2AMEN1OPRM1OPRD1NR1H4

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7678818-B2 Anthranilamide and 2-amino-heteroarene-carboxamide compounds HOFFMANN-LA ROCHE INC. (US) 2010-03-16 US claimed
EP-1984340-B1 ANTHRANILAMIDE/2-AMINO-HETEROARENE CARBOXAMIDE DERIVATIVES HOFFMANN LA ROCHE (CH) 2012-06-27 EP disclosed