SCHEMBL12559956

SCHEMBL12559956

COC(=O)c1cc(O)cc(C(=O)OC2CCC(OC(=O)c3cc(O)cc(C(=O)OC4CCC(C)c5ccccc54)c3)c3ccccc32)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 2/20 0.46
▸ CA1 P00915 2/20 0.46
▸ CA2 P00918 2/20 0.46
▸ CA7 P43166 2/20 0.46
▸ CA9 Q16790 2/20 0.46
▸ CA14 Q9ULX7 2/20 0.46
▸ HSD17B10 Q99714 3/20 0.41
▸ HPGD P15428 3/20 0.39
▸ LMNA P02545 3/20 0.39
▸ TSHR P16473 3/20 0.38
▸ ALDH1A1 P00352 3/20 0.38
▸ KDM4E B2RXH2 2/20 0.38
▸ KMT2A Q03164 4/20 0.38
▸ MAPT P10636 1/20 0.37
▸ ALOX15 P16050 1/20 0.37
▸ L3MBTL1 Q9Y468 2/20 0.37
▸ MEN1 O00255 3/20 0.37
▸ RBP4 P02753 1/20 0.36
▸ POLB P06746 2/20 0.36
▸ NPSR1 Q6W5P4 2/20 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
SCHEMBL21840899 0.81 TRPM8 (0.49) LMNATSHRALDH1A1KMT2AMEN1
SCHEMBL26419677 0.77 TAS1R3 (0.39) HSD17B10HPGDTSHRALDH1A1KDM4E
SCHEMBL12159639 0.73 BCHE (0.39) HSD17B10ALDH1A1POLBTAS1R3TAS1R1
SCHEMBL46504 0.71 CA12 (0.91) CA12CA1CA2CA7CA9
SCHEMBL20306561 0.70 TAS1R3 (0.36) LMNAMAPTPOLBNPSR1TAS1R3
SCHEMBL2191290 0.69 NOTUM (0.39) TSHRKDM4EKMT2AMAPTPOLB
SCHEMBL172877 0.68 SLC6A2 (0.38) TAS1R3TAS1R1TAS1R2
Methyl 3,5-Dihydroxybenzoate SCHEMBL38869 0.67 CA1 (1.00) CA12CA1CA2CA7CA9
SCHEMBL12416539 0.66 RIPK1 (0.38) TAS1R3TAS1R1TAS1R2
SCHEMBL16889107 0.65 TAS1R3 (0.41) HSD17B10TSHRALDH1A1KMT2AMEN1

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
US-8895691-B2 Acid-labile polymers and monomers for their construction THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 2014-11-25 — — US disclosed
US-20110152496-A1 ACID-LABILE POLYMERS AND MONOMERS FOR THEIR CONSTRUCTION THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 2011-06-23 — — US disclosed
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