SCHEMBL20344759

SCHEMBL20344759

C=C1C=Cc2cc(NS(=O)(=O)Cc3c(F)c(F)c(C)c(F)c3F)ccc2N1CCC

nearest known ligand 0.31

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
BRAF P15056 1/20 0.31
PGR P06401 1/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31
HSD17B10 Q99714 1/20 0.31
BRPF1 P55201 1/20 0.31
BRD4 O60885 2/20 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
SCHEMBL29424983 0.77 BRD4 (0.42) KDM4EALDH1A1HPGDHSD17B10BRD4
SCHEMBL20344739 0.77 BRD4 (0.42) KDM4EALDH1A1HPGDHSD17B10BRD4
SCHEMBL20344779 0.77 HDAC8 (0.36) BRAFHPGDBRPF1BRD4
SCHEMBL20616468 0.76 BRD4 (0.40) KDM4EALDH1A1HPGDHSD17B10BRPF1
SCHEMBL20616464 0.76 BRD4 (0.37) PGRKDM4EALDH1A1HPGDHSD17B10
SCHEMBL20616471 0.76 BRD4 (0.37) KDM4EALDH1A1HPGDHSD17B10BRPF1
SCHEMBL20616508 0.76 BRD4 (0.32) KDM4EALDH1A1HPGDHSD17B10BRPF1
SCHEMBL20616459 0.76 BRD4 (0.37) BRAFKDM4EALDH1A1HPGDHSD17B10
SCHEMBL20344735 0.75 RXRA (0.36) PGRKDM4EALDH1A1HPGDHSD17B10
SCHEMBL20616482 0.75 NR3C2 (0.35) PGRKDM4EALDH1A1HPGDHSD17B10

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
EP-3342766-A1 SMALL MOLECULE COMPOUND FOR ENHANCING PLANT STRESS RESISTANCE Shanghai Institutes for Biological Sciences, Chinese Academy of Sciences (CN) 2018-07-04 EP disclosed