SCHEMBL10719018

SCHEMBL10719018

CC(N(NC(=O)c1ccccc1)C(=O)c1ccccc1O)C(C)(C)C

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.47
▸ CYP3A4 P08684 1/20 0.44
▸ CYP2C9 P11712 1/20 0.44
▸ KDM4E B2RXH2 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ HPGD P15428 1/20 0.43
▸ HSD17B10 Q99714 1/20 0.43
▸ GSTA1 P08263 1/20 0.43

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
SCHEMBL9877218 0.86 POLB (0.58) POLBCYP3A4CYP2C9ALDH1A1LMNA
SCHEMBL9824746 0.86 POLB (0.46) POLBCYP3A4CYP2C9ALDH1A1HPGD
SCHEMBL9825708 0.82 ALDH1A1 (0.46) POLBKDM4EALDH1A1HPGD
SCHEMBL9825783 0.81 POLB (0.52) POLBCYP3A4CYP2C9ALDH1A1LMNA
SCHEMBL10718302 0.80 POLB (0.51) POLBCYP3A4CYP2C9KDM4EALDH1A1
SCHEMBL10718578 0.80 ABCB1 (0.45) LMNA
SCHEMBL10718541 0.78 POLB (0.72) POLBCYP3A4CYP2C9
SCHEMBL10722631 0.76 POLB (0.47) POLBCYP3A4CYP2C9
SCHEMBL10721420 0.76 LMNA (0.44) ALDH1A1LMNA
SCHEMBL9877608 0.73 MEN1 (0.43) ALDH1A1LMNAHPGD

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