SCHEMBL11047587

SCHEMBL11047587

O=C(c1ccc(Cl)cc1)c1ccc(NS(=O)(=O)c2ccccc2)cc1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.76
KMT2A Q03164 4/20 0.76
PGR P06401 2/20 0.74
ITGA1 P56199 2/20 0.67
CES1 P23141 1/20 0.64
BRD4 O60885 1/20 0.62
ALDH1A1 P00352 1/20 0.59
PKM P14618 1/20 0.59
IL1RN P18510 1/20 0.58
KEAP1 Q14145 1/20 0.58
ERAP1 Q9NZ08 1/20 0.58
WDR5 P61964 1/20 0.57
TP53 P04637 1/20 0.56
GAA P10253 1/20 0.56
MAPT P10636 1/20 0.56
THRB P10828 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
CA12 O43570 1/20 0.56
CA9 Q16790 1/20 0.56
BDKRB1 P46663 1/20 0.56

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
SCHEMBL2133710 0.88 CES1 (0.81) MEN1KMT2APGRCES1ALDH1A1
SCHEMBL4651308 0.85 CES1 (0.65) MEN1KMT2APGRITGA1CES1
SCHEMBL9285136 0.84 WDR5 (0.74) MEN1KMT2APGRCES1ALDH1A1
SCHEMBL17593181 0.82 KMT2A (0.92) MEN1KMT2AALDH1A1PKMMAPT
SCHEMBL893905 0.82 CA12 (0.73) MEN1KMT2APGRITGA1ALDH1A1
SCHEMBL7584032 0.81 CES1 (0.81) MEN1KMT2APGRCES1ALDH1A1
SCHEMBL9310816 0.81 NAMPT (0.71) MEN1KMT2APGRITGA1CES1
SCHEMBL3468159 0.81 PGR (0.68) MEN1KMT2APGRITGA1BRD4
SCHEMBL13028457 0.80 WDR5 (0.68) MEN1KMT2APGRCES1WDR5
SCHEMBL5801508 0.79 PGR (0.91) MEN1KMT2APGRCES1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4432994-A SUBSTITUTED BENZOPHENONE HYDRAZONES AS INSECTICIDES, MITICIDES THE BOOTS COMPANY (GB) 1984-02-21 US disclosed
US-4331680-A SUBSTITUTED BENZOPHENONE HYDRAZONE, INSECTICIDES THE BOOTS COMPANY (GB) 1982-05-25 US disclosed
EP-0026040-A1 Substituted benzophenone hydrazones, pesticidal compositions containing them and method of combating pests FBC LIMITED (GB) 1981-04-01 EP disclosed