SCHEMBL1449535

SCHEMBL1449535

CCOc1cccc(O)c1/C(C)=N\C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA7 P43166 1/20 0.43
CA9 Q16790 1/20 0.43
CA14 Q9ULX7 1/20 0.43
MAOB P27338 2/20 0.41
KDM4E B2RXH2 2/20 0.40
MAPT P10636 2/20 0.39
MAPK1 P28482 2/20 0.39
GAA P10253 1/20 0.39
PTPN1 P18031 2/20 0.39
ALDH1A1 P00352 2/20 0.38
GLA P06280 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
THRB P10828 1/20 0.37
NPC1 O15118 1/20 0.36
CASP3 P42574 1/20 0.36

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
SCHEMBL1449534 1.00 CA12 (0.43) CA12CA1CA2CA7CA9
SCHEMBL1449537 1.00 CA12 (0.43) CA12CA1CA2CA7CA9
SCHEMBL1783479 0.82 CA12 (0.42) CA12CA1CA2CA7CA9
SCHEMBL1449440 0.81 TP53 (0.53) CA12CA1CA2CA7CA9
SCHEMBL1449437 0.81 TP53 (0.53) CA12CA1CA2CA7CA9
SCHEMBL1449441 0.81 TP53 (0.53) CA12CA1CA2CA7CA9
SCHEMBL29788611 0.79 MAOB (0.61) CA12CA1CA2CA7CA9
SCHEMBL1448829 0.79 MAOB (0.61) CA12CA1CA2CA7CA9
SCHEMBL1449483 0.78 THRB (0.52) CA12CA1CA2CA7CA9
SCHEMBL1449485 0.78 THRB (0.52) CA12CA1CA2CA7CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2373758-B1 PHOTOCHROMIC OPTICAL ARTICLES PREPARED WITH REVERSIBLE THERMOCHROMIC MATERIALS TRANSITIONS OPTICAL INC (US) 2017-05-10 EP disclosed
US-8547625-B2 Photochromic optical articles prepared with reversible thermochromic materials TRANSITIONS OPTICAL, INC. (US) 2013-10-01 US disclosed
EP-2373758-A1 PHOTOCHROMIC OPTICAL ARTICLES PREPARED WITH REVERSIBLE THERMOCHROMIC MATERIALS TRANSITIONS OPTICAL, INC. (US) 2011-10-12 EP disclosed
US-7911676-B2 Photochromic optical articles prepared with reversible thermochromic materials TRANSITIONS OPTICAL, INC. (US) 2011-03-22 US disclosed
US-20110051223-A1 PHOTOCHROMIC OPTICAL ARTICLES PREPARED WITH REVERSIBLE THERMOCHROMIC MATERIALS TRANSITIONS OPTICAL, INC. (FL) 2011-03-03 US disclosed
WO-2010074969-A1 PHOTOCHROMIC OPTICAL ARTICLES PREPARED WITH REVERSIBLE THERMOCHROMIC MATERIALS TRANSITIONS OPTICAL, INC. (US) 2010-07-01 WO disclosed
US-20100149620-A1 PHOTOCHROMIC OPTICAL ARTICLES PREPARED WITH REVERSIBLE THERMOCHROMIC MATERIALS TRANSITIONS OPTICAL, INC. (US) 2010-06-17 US disclosed