SCHEMBL9859293

SCHEMBL9859293

COC(=O)CC(=O)c1ccc(C(F)(F)F)c(Cl)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
NOTUM Q6P988 2/20 0.46
HTT P42858 1/20 0.43
MRGPRX4 Q96LA9 1/20 0.41
RAPGEF3 O95398 2/20 0.39
MAPT P10636 3/20 0.39
LMNA P02545 2/20 0.39
GAA P10253 2/20 0.39
KDM4E B2RXH2 1/20 0.39
PDK1 Q15118 2/20 0.39
PDK2 Q15119 2/20 0.39
PDK3 Q15120 2/20 0.39
PDK4 Q16654 2/20 0.39
EPHX2 P34913 1/20 0.39
HPGD P15428 1/20 0.38
RAB9A P51151 2/20 0.38
KDR P35968 1/20 0.38
GPBAR1 Q8TDU6 1/20 0.38
CYP1A2 P05177 1/20 0.38

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
SCHEMBL21776928 0.88 KDR (0.48) MEN1KMT2ANOTUMHTTMAPT
SCHEMBL24959794 0.81 NOTUM (0.42) NOTUMHTTMRGPRX4RAPGEF3MAPT
SCHEMBL28144725 0.81 NOTUM (0.67) MEN1KMT2ANOTUMHTTMRGPRX4
SCHEMBL9858813 0.81 MEN1 (0.38) MEN1KMT2ANOTUMHTTMRGPRX4
SCHEMBL9859767 0.81 GPBAR1 (0.42) MEN1KMT2ANOTUMHTTMRGPRX4
SCHEMBL31266408 0.81 HPGD (0.55) MEN1KMT2AKDM4EHPGDRAB9A
SCHEMBL4109568 0.81 HPGD (0.55) MEN1KMT2AKDM4EHPGDRAB9A
SCHEMBL23294373 0.80 MEN1 (0.50) MEN1KMT2AHTTMAPTKDM4E
SCHEMBL9858842 0.80 HDAC1 (0.47) NOTUMHTTMRGPRX4RAPGEF3LMNA
SCHEMBL25403646 0.79 PLOD2 (0.41) MEN1KMT2ANOTUMMRGPRX4RAPGEF3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0153127-B1 N-ARYL-3-ARYL-4,5-DIHYDRO-1H-PYRAZOLE-1-CARBOXAMIDES, PROCESSES FOR THEIR PRODUCTION, INSECTICIDAL COMPOSITIONS CONTAINING THEM AND METHODS FOR COMBATTING INSECTS ROHM AND HAAS COMPANY (US) 1991-04-03 EP disclosed
US-4863947-A PESTICIDES, INSECTICIDES ROHM AND HAAS (US) 1989-09-05 US disclosed
US-4663341-A Insecticidal n-aryl-3-aryl-4,5-dihydro-1h-pyrazole-1-carboxamides ROHM AND HAAS COMPANY (US) 1987-05-05 US disclosed
EP-0153127-A2 N-aryl-3-aryl-4,5-dihydro-1H-pyrazole-1-carboxamides, processes for their production, insecticidal compositions containing them and methods for combatting insects ROHM AND HAAS COMPANY (US) 1985-08-28 EP disclosed