SCHEMBL9756491

SCHEMBL9756491

CC(C)(C)N(NC(=O)C1CCCCCCC1)C(=O)c1ccc(Cl)cc1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.50
CYP3A4 P08684 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
HTT P42858 1/20 0.45
HPGD P15428 3/20 0.45
RAB9A P51151 2/20 0.45
ALDH1A1 P00352 1/20 0.45
POLB P06746 2/20 0.43
EPHX2 P34913 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
GAA P10253 2/20 0.43
AGER Q15109 1/20 0.41
MEN1 O00255 1/20 0.41
NPC1 O15118 1/20 0.41
ABCB1 P08183 1/20 0.41

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
SCHEMBL9755861 1.00 KMT2A (0.50) KMT2ACYP3A4CYP2C9CYP2C19HTT
SCHEMBL9755856 1.00 KMT2A (0.50) KMT2ACYP3A4CYP2C9CYP2C19HTT
SCHEMBL9756105 0.99 KMT2A (0.51) KMT2ACYP3A4CYP2C9CYP2C19HTT
SCHEMBL9507243 0.96 KMT2A (0.48) KMT2ACYP3A4CYP2C9CYP2C19HTT
SCHEMBL9756082 0.93 POLB (0.50) CYP3A4CYP2C9CYP2C19HTTHPGD
SCHEMBL9755967 0.86 POLB (0.60) KMT2ACYP3A4CYP2C9CYP2C19HTT
SCHEMBL9756366 0.86 POLB (0.60) KMT2ACYP3A4CYP2C9CYP2C19HTT
SCHEMBL8173463 0.86 POLB (0.60) KMT2ACYP3A4CYP2C9CYP2C19HTT
SCHEMBL9756160 0.85 POLB (0.61) KMT2ACYP3A4CYP2C9CYP2C19HTT
SCHEMBL9755963 0.82 POLB (0.61) KMT2ACYP3A4CYP2C9CYP2C19HTT

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-0232075-A1 Insecticidal N'-substituted-N-alkylcarbonyl-N'-acyl hydrazines ROHM AND HAAS COMPANY (US) 1987-08-12 EP disclosed