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SCHEMBL9756507

SCHEMBL9756507

CC(C)(C)N(NC(=O)c1cccc(F)c1)C(=O)/C1=C/CCCCCC1

nearest known ligand 0.58

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 1/20 0.48
▸ CYP2C9 P11712 1/20 0.48
▸ ABCB1 P08183 5/20 0.47
▸ POLB P06746 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
SCHEMBL9756037 1.00 CYP3A4 (0.48) CYP3A4CYP2C9ABCB1POLB
SCHEMBL9756208 1.00 CYP3A4 (0.48) CYP3A4CYP2C9ABCB1POLB
SCHEMBL9755870 0.99 CYP3A4 (0.49) CYP3A4CYP2C9ABCB1POLB
SCHEMBL9756206 0.91 CYP3A4 (0.51) CYP3A4CYP2C9ABCB1POLB
SCHEMBL9756214 0.91 CYP3A4 (0.51) CYP3A4CYP2C9ABCB1POLB
SCHEMBL9756034 0.91 CYP3A4 (0.51) CYP3A4CYP2C9ABCB1POLB
SCHEMBL9755869 0.90 CYP3A4 (0.52) CYP3A4CYP2C9ABCB1POLB
SCHEMBL9756378 0.90 CYP3A4 (0.53) CYP3A4CYP2C9ABCB1POLB
SCHEMBL9756081 0.88 ABCB1 (0.63) CYP3A4CYP2C9ABCB1POLB
SCHEMBL9755999 0.88 ABCB1 (0.63) CYP3A4CYP2C9ABCB1POLB

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
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