SCHEMBL9825307

SCHEMBL9825307

CCc1ccc(C(=O)N(NC(=O)c2ccccc2I)C(C)(C)C)cc1

nearest known ligand 0.71

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.70
SMN1; SMN2 Q16637 1/20 0.70
ABCB1 P08183 2/20 0.58
CYP3A4 P08684 1/20 0.58
POLB P06746 1/20 0.53

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
SCHEMBL9825310 0.90 HPGD (0.70) HPGDSMN1; SMN2ABCB1CYP3A4
Hydrochloric Acid SCHEMBL8177409 0.89 HPGD (0.68) HPGDSMN1; SMN2ABCB1CYP3A4
SCHEMBL9824930 0.87 POLB (0.70) ABCB1CYP3A4POLB
SCHEMBL10720263 0.85 HPGD (0.70) HPGDSMN1; SMN2
Hydrochloric Acid SCHEMBL8166751 0.84 HPGD (0.68) HPGDSMN1; SMN2
SCHEMBL9714554 0.83 HPGD (0.89) HPGDSMN1; SMN2ABCB1CYP3A4POLB
SCHEMBL8773650 0.83 HPGD (0.89) HPGDSMN1; SMN2ABCB1CYP3A4POLB
SCHEMBL8423072 0.83 HPGD (1.00) HPGDSMN1; SMN2ABCB1CYP3A4POLB
SCHEMBL9825684 0.81 SMN1; SMN2 (0.64) HPGDSMN1; SMN2ABCB1CYP3A4POLB
SCHEMBL5058454 0.81 HPGD (0.75) HPGDSMN1; SMN2ABCB1CYP3A4

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-0236618-B1 INSECTICIDAL N'-SUBSTITUTED-N,N'-DIACYLHYDRAZINES ROHM AND HAAS COMPANY (US) 1991-02-27 EP disclosed