SCHEMBL9714465

SCHEMBL9714465

CC(C)(C)N(NC(=O)c1cc(Cl)cc(Cl)c1)C(=O)c1ccc(I)cc1

nearest known ligand 0.62

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.55
HPGD P15428 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
CYP3A4 P08684 2/20 0.51
CYP2C9 P11712 1/20 0.51
ABCB1 P08183 3/20 0.51

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
SCHEMBL9714469 0.95 POLB (0.55) POLBHPGDSMN1; SMN2CYP3A4CYP2C9
SCHEMBL9714120 0.90 POLB (0.59) POLBHPGDSMN1; SMN2CYP3A4CYP2C9
SCHEMBL9714472 0.88 POLB (0.56) POLBHPGDSMN1; SMN2CYP3A4CYP2C9
SCHEMBL9714296 0.86 POLB (0.75) POLBCYP3A4CYP2C9ABCB1
SCHEMBL9714125 0.85 POLB (0.59) POLBHPGDSMN1; SMN2CYP3A4CYP2C9
Hydrochloric Acid SCHEMBL8173165 0.83 POLB (0.57) POLBHPGDSMN1; SMN2CYP3A4CYP2C9
SCHEMBL9714450 0.83 POLB (0.51) POLBHPGDSMN1; SMN2CYP3A4CYP2C9
SCHEMBL9714476 0.82 ABCB1 (0.61) POLBHPGDSMN1; SMN2CYP3A4CYP2C9
SCHEMBL8773656 0.82 POLB (0.82) POLBHPGDSMN1; SMN2CYP3A4CYP2C9
SCHEMBL10718820 0.82 POLB (0.82) POLBHPGDSMN1; SMN2CYP3A4CYP2C9

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
EP-0245950-B1 INSECTICIDAL N-SUBSTITUTED-N' - SUBSTITUTED-N, N'-DIACYLHYDRAZINES ROHM AND HAAS COMPANY (US) 1992-06-17 EP disclosed