SCHEMBL16580957

SCHEMBL16580957

CCOC(=O)c1cnc(I)cc1Cl

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BAZ2B Q9UIF8 1/20 0.49
▸ BAZ2A Q9UIF9 1/20 0.49
▸ MAPT P10636 4/20 0.46
▸ ALDH1A1 P00352 3/20 0.46
▸ HPGD P15428 2/20 0.46
▸ TDP1 Q9NUW8 1/20 0.46
▸ CYP4F2 P78329 1/20 0.46
▸ CYP4A11 Q02928 1/20 0.46
▸ KMT2A Q03164 3/20 0.45
▸ CA1 P00915 2/20 0.45
▸ CA2 P00918 2/20 0.45
▸ LMNA P02545 2/20 0.45
▸ L3MBTL1 Q9Y468 2/20 0.45
▸ MAPK1 P28482 1/20 0.45
▸ CA12 O43570 1/20 0.45
▸ CA9 Q16790 1/20 0.45
▸ KDM4E B2RXH2 4/20 0.44
▸ MEN1 O00255 2/20 0.44
▸ TP53 P04637 1/20 0.44
▸ GAA P10253 1/20 0.44

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
SCHEMBL3652621 0.84 BAZ2B (0.51) BAZ2BBAZ2AMAPTALDH1A1HPGD
SCHEMBL29574609 0.84 BAZ2B (0.51) BAZ2BBAZ2AMAPTALDH1A1HPGD
SCHEMBL190973 0.84 BAZ2B (0.51) BAZ2BBAZ2AMAPTALDH1A1HPGD
SCHEMBL24770186 0.80 BAZ2B (0.48) BAZ2BBAZ2AMAPTALDH1A1HPGD
SCHEMBL22717325 0.80 BAZ2B (0.48) BAZ2BBAZ2AMAPTALDH1A1HPGD
SCHEMBL1812364 0.80 ALDH1A1 (0.54) BAZ2BBAZ2AMAPTALDH1A1HPGD
SCHEMBL19190925 0.79 NNMT (0.61) BAZ2BBAZ2AMAPTALDH1A1HPGD
SCHEMBL22717417 0.79 BAZ2B (0.47) BAZ2BBAZ2AMAPTALDH1A1HPGD
SCHEMBL17648758 0.79 BAZ2B (0.50) BAZ2BBAZ2AMAPTALDH1A1HPGD
SCHEMBL23356415 0.79 KDM4E (0.53) BAZ2BBAZ2AMAPTALDH1A1HPGD

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-2015038417-A1 COMPOUNDS FOR REGULATING FAK AND/OR SRC PATHWAYS ASANA BIOSCIENCES, LLC (US) 2015-03-19 — — WO disclosed
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