SCHEMBL27680940

SCHEMBL27680940

COC(=O)c1c(C(=O)OC)c2c(C(=O)OC)ccc3c4cccc5cccc(c(c1C(=O)OC)c23)c54

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 1/20 0.41
▸ CA1 P00915 1/20 0.41
▸ CA2 P00918 1/20 0.41
▸ CA7 P43166 1/20 0.41
▸ CA9 Q16790 1/20 0.41
▸ CA14 Q9ULX7 1/20 0.41
▸ KDM4E B2RXH2 4/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ NPSR1 Q6W5P4 2/20 0.40
▸ HPGD P15428 1/20 0.40
▸ MAPT P10636 4/20 0.39
▸ NCEH1 Q6PIU2 1/20 0.38
▸ MAPK10 P53779 2/20 0.38
▸ MAPK8 P45983 1/20 0.38
▸ MAPK9 P45984 1/20 0.38
▸ NR4A2 P43354 5/20 0.38
▸ MEN1 O00255 5/20 0.37
▸ KMT2A Q03164 5/20 0.37
▸ RCE1 Q9Y256 1/20 0.37
▸ ALOX12 P18054 1/20 0.37

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
SCHEMBL28706280 0.83 KDM4E (0.45) KDM4EALDH1A1NPSR1HPGDMAPT
SCHEMBL14262734 0.83 CA12 (0.53) CA12CA1CA2CA7CA9
SCHEMBL28174026 0.78 TSHR (0.49) KDM4EALDH1A1TSHRSMN1; SMN2LMNA
SCHEMBL709221 0.75 HSD17B10 (0.41) CA12CA1CA2CA7CA9
SCHEMBL19082604 0.74 KDM4E (0.50) CA12CA1CA2CA7CA9
SCHEMBL19082607 0.74 KDM4E (0.50) CA12CA1CA2CA7CA9
SCHEMBL29576400 0.74 KDM4E (0.58) CA12CA1CA2CA7CA9
SCHEMBL68712 0.74 KDM4E (0.58) CA12CA1CA2CA7CA9
SCHEMBL19082608 0.73 KDM4E (0.46) CA12CA1CA2CA7CA9
SCHEMBL1538693 0.73 ALDH1A1 (0.53) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1910433-A Impermeability tests of closed systems with the aid of fluorescent dyes HEIMEIER GMBH METALL THEODOR (DE) 2007-02-07 — — CN disclosed
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