SCHEMBL9557192

SCHEMBL9557192

CCN(C(=O)c1ccc(Cl)cc1)N(C(=O)c1ccc(Cl)cc1)C(C)(C)C

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 2/20 0.45
OPRD1 P41143 2/20 0.45
OPRK1 P41145 1/20 0.45
NPC1 O15118 1/20 0.40
ALDH1A1 P00352 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
POLB P06746 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
CES2 O00748 1/20 0.38
CES1 P23141 1/20 0.38
HTT P42858 1/20 0.38
MLYCD O95822 1/20 0.38
GRM5 P41594 1/20 0.38
GSK3B P49841 1/20 0.38
CYP3A4 P08684 1/20 0.38
P2RX7 Q99572 1/20 0.38
ALOX15 P16050 1/20 0.37
TSHR P16473 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
SCHEMBL9557503 0.94 CES2 (0.47) OPRM1OPRD1OPRK1NPC1L3MBTL1
SCHEMBL9557442 0.94 ALDH1A1 (0.45) OPRM1OPRD1OPRK1ALDH1A1L3MBTL1
SCHEMBL9557370 0.94 CES2 (0.47) OPRM1OPRD1OPRK1NPC1L3MBTL1
SCHEMBL9558150 0.94 ALDH1A1 (0.45) OPRM1OPRD1OPRK1ALDH1A1L3MBTL1
SCHEMBL9557764 0.93 OPRM1 (0.40) OPRM1OPRD1OPRK1NPC1ALDH1A1
SCHEMBL9557390 0.92 OPRM1 (0.40) OPRM1OPRD1OPRK1NPC1ALDH1A1
SCHEMBL9557564 0.90 MCHR1 (0.43) OPRM1OPRD1OPRK1POLBCES2
SCHEMBL9558080 0.90 TSHR (0.48) OPRM1OPRD1OPRK1ALDH1A1MEN1
SCHEMBL9557729 0.89 ALDH1A1 (0.49) OPRM1OPRD1OPRK1ALDH1A1MEN1
SCHEMBL9557504 0.87 HPGD (0.51) NPC1ALDH1A1POLBMEN1KMT2A

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-5225443-A Lepidotera and Coleoptera insecticides to protect plants ROHM AND HAAS COMPANY (US) 1993-07-06 US disclosed
EP-0245950-A2 Insecticidal n-substituted-n' - substituted-n, n'-diacylhydrazines ROHM AND HAAS COMPANY (US) 1987-11-19 EP disclosed