SCHEMBL9756450

SCHEMBL9756450

CC(C)(C)N(NC(=O)c1ccccc1)C(=O)C1=CCCCCCC1

nearest known ligand 0.62

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.62
CYP3A4 P08684 1/20 0.58
CYP2C9 P11712 1/20 0.58
HPGD P15428 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47

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
SCHEMBL9756512 1.00 POLB (0.62) POLBCYP3A4CYP2C9HPGDSMN1; SMN2
SCHEMBL9756448 1.00 POLB (0.62) POLBCYP3A4CYP2C9HPGDSMN1; SMN2
SCHEMBL9507237 0.99 POLB (0.63) POLBCYP3A4CYP2C9HPGDSMN1; SMN2
SCHEMBL9756452 0.90 POLB (0.62) POLBCYP3A4CYP2C9HPGDSMN1; SMN2
SCHEMBL9756445 0.90 POLB (0.62) POLBCYP3A4CYP2C9HPGDSMN1; SMN2
SCHEMBL9756449 0.90 POLB (0.62) POLBCYP3A4CYP2C9HPGDSMN1; SMN2
SCHEMBL8174421 0.89 POLB (0.63) POLBCYP3A4CYP2C9HPGDSMN1; SMN2
SCHEMBL9756440 0.88 POLB (0.70) POLBCYP3A4CYP2C9
SCHEMBL9756359 0.88 HPGD (0.48) POLBHPGDSMN1; SMN2
SCHEMBL9756394 0.88 HPGD (0.48) POLBHPGDSMN1; SMN2

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-0234944-B1 INSECTICIDAL N'-SUBSTITUTED-N-ACYL-N'-ALKYLCARBONYLHYDRAZINES ROHM AND HAAS COMPANY (US) 1991-04-10 EP disclosed
EP-0232075-B1 INSECTICIDAL N'-SUBSTITUTED-N-ALKYLCARBONYL-N'-ACYL HYDRAZINES ROHM AND HAAS COMPANY (US) 1991-03-13 EP disclosed
EP-0234944-A1 Insecticidal N'-substituted-N-acyl-N'-alkylcarbonylhydrazines ROHM AND HAAS COMPANY (US) 1987-09-02 EP disclosed