SCHEMBL9714293

SCHEMBL9714293

C=Cc1ccc(C(=O)N(NC(=O)c2ccccc2Br)C(C)(C)C)cc1

nearest known ligand 0.61

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.52
ABCB1 P08183 1/20 0.49
CYP3A4 P08684 1/20 0.46
CYP2C9 P11712 1/20 0.46
HPGD P15428 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45

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
SCHEMBL9714286 0.91 POLB (0.52) POLB
SCHEMBL9714356 0.86 POLB (0.70) POLBABCB1CYP3A4CYP2C9
SCHEMBL10721442 0.83 POLB (0.65) POLBABCB1CYP3A4CYP2C9HPGD
SCHEMBL10719304 0.82 ABCB1 (0.56) POLBABCB1
SCHEMBL9714510 0.81 POLB (0.52) POLBABCB1HPGDSMN1; SMN2
SCHEMBL10721301 0.79 ABCB1 (0.77) POLBABCB1CYP3A4CYP2C9
SCHEMBL9557567 0.77 HPGD (0.39) POLBHPGDSMN1; SMN2
SCHEMBL10718887 0.77 POLB (0.63) POLBABCB1CYP3A4CYP2C9
SCHEMBL8773659 0.76 POLB (0.70) POLBCYP3A4CYP2C9
SCHEMBL9714450 0.76 POLB (0.51) POLBABCB1CYP3A4CYP2C9HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0245950-B1 INSECTICIDAL N-SUBSTITUTED-N' - SUBSTITUTED-N, N'-DIACYLHYDRAZINES ROHM AND HAAS COMPANY (US) 1992-06-17 EP disclosed
EP-0236618-B1 INSECTICIDAL N'-SUBSTITUTED-N,N'-DIACYLHYDRAZINES ROHM AND HAAS COMPANY (US) 1991-02-27 EP disclosed
US-4985461-A Insecticidal N'-substituted-N,N'-diacylhydrazines ROHM AND HAAS COMPANY (US) 1991-01-15 US disclosed
EP-0236618-A2 Insecticidal N'-substituted-N,N'-diacylhydrazines ROHM AND HAAS COMPANY (US) 1987-09-16 EP disclosed