SCHEMBL3786818

SCHEMBL3786818

O=S(=O)(Oc1cc2c(Cl)c(F)cc(F)c2cn1)Oc1cc2c(Cl)c(F)cc(F)c2cn1

nearest known ligand 0.31

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SLC40A1 Q9NP59 1/20 0.31
DAO P14920 1/20 0.31
DDO Q99489 1/20 0.31
MEN1 O00255 1/20 0.30
PABPC1 P11940 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
Sulfuric Acid SCHEMBL3786814 0.73 DAO (0.37) SLC40A1DAODDO
SCHEMBL2748609 0.69 DAO (0.38) DAODDO
SCHEMBL2749443 0.66 PDE4A (0.43) SLC40A1MEN1PABPC1KMT2A
SCHEMBL2748946 0.66 PDE4A (0.38) MEN1PABPC1KMT2A
SCHEMBL23578711 0.59 PDE4A (0.31)
SCHEMBL2749205 0.59 PDE4A (0.40)
SCHEMBL26386067 0.57 TDO2 (0.40) MEN1PABPC1KMT2A
SCHEMBL9358268 0.54 CYP3A4 (0.41)
SCHEMBL999151 0.54 ALDH1A1 (0.33) SLC40A1
SCHEMBL31358029 0.53 METAP2 (0.36)

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-2265270-A1 2-AMINOPYRIDINE KINASE INHIBITORS OSI Pharmaceuticals, Inc. (US) 2010-12-29 EP disclosed
WO-2009099982-A1 2-AMINOPYRIDINE KINASE INHIBITORS OSI PHARMACEUTICALS, INC. (US) 2009-08-13 WO disclosed