SCHEMBL8436945

SCHEMBL8436945

Cc1cc(C)c(B(c2c(C)cc(C)cc2CCl)c2c(C)cc(C)cc2CCl)c(CCl)c1

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.40
KDM4E B2RXH2 1/20 0.40
PON1 P27169 1/20 0.40
MAPK1 P28482 1/20 0.40
RAB9A P51151 1/20 0.40
RAPGEF4 Q8WZA2 5/20 0.36
NPSR1 Q6W5P4 1/20 0.31
TSHR P16473 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
SCHEMBL7462364 0.90 KDM4E (0.37) KMT2AKDM4EPON1MAPK1RAB9A
SCHEMBL7458895 0.88 KMT2A (0.36) KMT2AKDM4EPON1MAPK1RAB9A
SCHEMBL7466160 0.87 KMT2A (0.35) KMT2AKDM4EPON1MAPK1RAB9A
SCHEMBL8588371 0.84 FFAR4 (0.37) KMT2AKDM4EPON1MAPK1RAB9A
SCHEMBL7464509 0.84 KDM4E (0.33) KMT2AKDM4EPON1MAPK1RAB9A
SCHEMBL7464484 0.84 KDM4E (0.33) KMT2AKDM4EPON1MAPK1RAB9A
SCHEMBL7462844 0.83 KDM4E (0.38) KMT2AKDM4EPON1MAPK1RAB9A
SCHEMBL7534862 0.82 KDM4E (0.33) KMT2AKDM4EPON1MAPK1RAB9A
SCHEMBL7462171 0.82 KDM4E (0.33) KMT2AKDM4EPON1MAPK1RAB9A
SCHEMBL7457203 0.82 KDM4E (0.33) KMT2AKDM4EPON1MAPK1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5952152-A POLYMERIZABLE MIXTURE COMPRISING AT LEAST ONE ETHYLENICALLY UNSATURATED COMPOUND AND AN ANIONIC BORON COMPOUND ACTIVATOR CIBA SPECIALTY CHEMICALS CORPORATION (US) 1999-09-14 US disclosed