SCHEMBL9200569

SCHEMBL9200569

CCOC(=O)c1ccc2c(c1)C(N)C(O)C(C)(C)O2

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.43
CA1 P00915 2/20 0.43
CA2 P00918 2/20 0.43
CA7 P43166 2/20 0.43
CA9 Q16790 2/20 0.43
CA14 Q9ULX7 2/20 0.43
ALDH1A1 P00352 2/20 0.43
MAPT P10636 2/20 0.43
RECQL P46063 2/20 0.43
LMNA P02545 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
MAOA P21397 1/20 0.42
ALOX15 P16050 2/20 0.41
ABCC9 O60706 2/20 0.41
USP2 O75604 1/20 0.41
HSD17B2 P37059 1/20 0.40
ESR1 P03372 1/20 0.40
ESR2 Q92731 1/20 0.40
KCNA5 P22460 1/20 0.39

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
SCHEMBL9200576 1.00 CA12 (0.43) CA12CA1CA2CA7CA9
SCHEMBL9200557 1.00 CA12 (0.43) CA12CA1CA2CA7CA9
SCHEMBL7048894 0.81 ABCC9 (0.43) ABCC9KDM4E
SCHEMBL7049232 0.81 ABCC9 (0.43) ABCC9KDM4E
SCHEMBL9194740 0.81 ABCC9 (0.43) ABCC9KDM4E
SCHEMBL9194748 0.81 ABCC9 (0.43) ABCC9KDM4E
Hydrochloric Acid SCHEMBL16863561 0.80 ABCC9 (0.42) ABCC9KDM4E
SCHEMBL24641052 0.78 KCNA5 (0.40) CA12CA1CA2CA7CA9
SCHEMBL29875616 0.78 KCNA5 (0.40) CA12CA1CA2CA7CA9
SCHEMBL29145832 0.78 KCNA5 (0.40) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0389861-B1 Benzopyran derivatives and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO (JP) 1995-08-23 EP disclosed
US-5104890-A Potassium channel activtors; vasodilators FUJISAWA PHARMACEUTICAL COMPANY, LTD. (JP) 1992-04-14 US disclosed
EP-0389861-A1 Benzopyran derivatives and processes for preparation thereof FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1990-10-03 EP disclosed