SCHEMBL9714531

SCHEMBL9714531

CC(C)(C)N(NC(=O)c1ccccc1)C(=O)c1cccc2ccccc12

nearest known ligand 0.78

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.67
CYP3A4 P08684 1/20 0.66
CYP2C9 P11712 1/20 0.66
ABCB1 P08183 1/20 0.57

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
SCHEMBL9714333 0.90 ABCB1 (0.55) POLBCYP3A4CYP2C9ABCB1
SCHEMBL9714534 0.89 POLB (0.67) POLBCYP3A4CYP2C9ABCB1
SCHEMBL9714217 0.82 POLB (0.72) POLBCYP3A4CYP2C9ABCB1
SCHEMBL10718541 0.82 POLB (0.72) POLBCYP3A4CYP2C9
SCHEMBL10721403 0.82 MMP3 (0.50) ABCB1
SCHEMBL10721366 0.81 ABCB1 (0.64) POLBCYP3A4CYP2C9ABCB1
SCHEMBL10748923 0.81 POLB (0.67) POLBCYP3A4CYP2C9
Rh-5849 SCHEMBL1538531 0.81 POLB (1.00) POLBCYP3A4CYP2C9ABCB1
SCHEMBL9826267 0.81 POLB (0.70) POLBCYP3A4CYP2C9
SCHEMBL9714379 0.81 POLB (0.70) POLBCYP3A4CYP2C9

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 3 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
EP-0236618-A2 Insecticidal N'-substituted-N,N'-diacylhydrazines ROHM AND HAAS COMPANY (US) 1987-09-16 EP disclosed