SCHEMBL2319832

SCHEMBL2319832

FC(F)(F)c1cc(Br)cc2nc(C(Cl)(Cl)Cl)[nH]c12

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CSNK2A1 P68400 1/20 0.33
▸ HCAR1 Q9BXC0 1/20 0.32
▸ PTGES O14684 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.30
▸ POLB P06746 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ HPGD P15428 1/20 0.30
▸ NPSR1 Q6W5P4 1/20 0.30
▸ MEN1 O00255 1/20 0.30
▸ KMT2A Q03164 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
SCHEMBL12020667 0.78 MAPT (0.41) CSNK2A1HCAR1PTGESKDM4EPOLB
SCHEMBL20495165 0.76 TRPV1 (0.36) PTGESKDM4EMAPTKMT2A
SCHEMBL2317964 0.73 EPRS1 (0.40) HCAR1
SCHEMBL1701401 0.69 NPSR1 (0.40) CSNK2A1KDM4EPOLBMAPTHPGD
SCHEMBL12501397 0.69 MAPT (0.49) CSNK2A1KDM4EPOLBMAPTHPGD
SCHEMBL2319088 0.69 NOTUM (0.46) KDM4EMAPTMEN1KMT2A
SCHEMBL10722861 0.68 NPSR1 (0.50) CSNK2A1KDM4EPOLBMAPTHPGD
SCHEMBL19742259 0.67 CACNA1H (0.46) POLB
SCHEMBL20495249 0.67 S1PR1 (0.39) KDM4E
SCHEMBL1509452 0.67 NOS1 (0.38) CSNK2A1PTGESKDM4EPOLBMAPT

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
WO-2011097491-A1 BENZIMIDAZOLE ANTIVIRAL AGENTS GLAXOSMITHKLINE LLC (US) 2011-08-11 — — WO disclosed
Send feedback