SCHEMBL433234

SCHEMBL433234

Cc1[nH]nc(C(F)(F)Cl)c1C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.43
KDM4E B2RXH2 1/20 0.43
POLB P06746 1/20 0.43
MAPT P10636 1/20 0.43
HCAR2 Q8TDS4 3/20 0.42
PDE4D Q08499 1/20 0.36
DAO P14920 1/20 0.35
NOTUM Q6P988 2/20 0.32
P2RX7 Q99572 2/20 0.31
MEN1 O00255 1/20 0.30
LMNA P02545 1/20 0.30
TTR P02766 1/20 0.30
CHUK O15111 1/20 0.30

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
SCHEMBL14822491 0.85 KDM4E (0.45) KMT2AKDM4EPOLBMAPTHCAR2
SCHEMBL20418 0.79 KDM4E (0.70) KMT2AKDM4EPOLBMAPTPDE4D
SCHEMBL9216975 0.76 HCAR2 (0.33) KMT2AKDM4EPOLBMAPTHCAR2
SCHEMBL20911 0.76 HCAR2 (0.43) KMT2AKDM4EPOLBMAPTHCAR2
SCHEMBL6257457 0.73 KDM4E (0.44) KMT2AKDM4EPOLBMAPTHCAR2
SCHEMBL28351122 0.71 PDE4D (0.36) KMT2AHCAR2PDE4DDAOMEN1
SCHEMBL1663754 0.70 PDE4D (0.59) KMT2AKDM4EHCAR2PDE4DDAO
SCHEMBL28319174 0.69 POLB (0.44) KMT2AKDM4EPOLBMAPTHCAR2
SCHEMBL27575758 0.69 HCAR2 (0.61) HCAR2PDE4DDAO
SCHEMBL28350977 0.68 HCAR2 (0.38) KMT2AHCAR2PDE4DDAOMEN1

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-2595962-A1 PROCESS FOR THE PREPARATION OF ESTERS OF 1-SUBSTITUTED-3-FLUOROALKYL-PYRAZOLE-4-CARBOXYLIC ACIDS SOLVAY SA (BE) 2013-05-29 EP disclosed
WO-2012010692-A1 PROCESS FOR THE PREPARATION OF ESTERS OF 1-SUBSTITUTED-3-FLUOROALKYL-PYRAZOLE-4-CARBOXYLIC ACIDS SOLVAY SA (BE) 2012-01-26 WO disclosed