SCHEMBL9507243

SCHEMBL9507243

CC(C)(C)N(NC(=O)C1CCC1)C(=O)c1ccc(Cl)cc1

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.48
GAA P10253 2/20 0.47
HPGD P15428 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
RAB9A P51151 1/20 0.47
CYP3A4 P08684 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
HTT P42858 1/20 0.46
POLB P06746 1/20 0.44
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
SCHEMBL9756105 0.97 KMT2A (0.51) KMT2AGAAHPGDSMN1; SMN2RAB9A
SCHEMBL9756491 0.96 KMT2A (0.50) KMT2AGAAHPGDSMN1; SMN2RAB9A
SCHEMBL9755856 0.96 KMT2A (0.50) KMT2AGAAHPGDSMN1; SMN2RAB9A
SCHEMBL9755861 0.96 KMT2A (0.50) KMT2AGAAHPGDSMN1; SMN2RAB9A
SCHEMBL9756082 0.94 POLB (0.50) HPGDSMN1; SMN2CYP3A4CYP2C9CYP2C19
SCHEMBL9755963 0.86 POLB (0.61) KMT2ASMN1; SMN2CYP3A4CYP2C9CYP2C19
SCHEMBL9756160 0.83 POLB (0.61) KMT2AHPGDSMN1; SMN2CYP3A4CYP2C9
SCHEMBL9756366 0.82 POLB (0.60) KMT2AHPGDSMN1; SMN2CYP3A4CYP2C9
SCHEMBL8173463 0.82 POLB (0.60) KMT2AHPGDSMN1; SMN2CYP3A4CYP2C9
SCHEMBL9755967 0.82 POLB (0.60) KMT2AHPGDSMN1; SMN2CYP3A4CYP2C9

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0361645-B1 ORGANIC HYDRAZINE DERIVATIVES FOR PHARMACEUTICAL USE ROHM AND HAAS COMPANY (US) 1993-09-29 EP disclosed
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-0361645-A2 Organic hydrazine derivatives for pharmaceutical use ROHM AND HAAS COMPANY (US) 1990-04-04 EP disclosed
EP-0232075-A1 Insecticidal N'-substituted-N-alkylcarbonyl-N'-acyl hydrazines ROHM AND HAAS COMPANY (US) 1987-08-12 EP disclosed