SCHEMBL723079

SCHEMBL723079

Cc1c(O)c(C(=O)O)c(C(=O)O)c(C(=O)O)c1O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LDHA P00338 3/20 0.45
LDHB P07195 3/20 0.45
CYP3A4 P08684 4/20 0.39
ACHE P22303 1/20 0.39
GLRA3 O75311 1/20 0.39
GLRB P48167 1/20 0.39
PLA2G2A P14555 1/20 0.39
PLA2G5 P39877 1/20 0.39
MAPT P10636 2/20 0.38
PSMG3 Q9BT73 1/20 0.38
FASN P49327 1/20 0.38
DPP4 P27487 1/20 0.37
POLB P06746 2/20 0.36
RECQL P46063 1/20 0.36
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA7 P43166 1/20 0.36
CA9 Q16790 1/20 0.36
CA14 Q9ULX7 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
SCHEMBL27364369 0.92 LDHA (0.43) LDHALDHBCYP3A4ACHEGLRA3
SCHEMBL15958196 0.88 LDHA (0.45) LDHALDHBCYP3A4ACHEGLRA3
SCHEMBL18677527 0.88 LDHA (0.45) LDHALDHBCYP3A4ACHEGLRA3
SCHEMBL18677490 0.86 LDHA (0.48) LDHALDHBCYP3A4ACHEGLRA3
SCHEMBL7577609 0.85 LDHA (0.46) LDHALDHBCYP3A4ACHEGLRA3
SCHEMBL29434000 0.83 LDHA (0.42) LDHALDHBCYP3A4ACHEGLRA3
SCHEMBL274096 0.83 LDHA (0.42) LDHALDHBCYP3A4ACHEGLRA3
SCHEMBL19194174 0.83 LDHA (0.52) LDHALDHBCYP3A4ACHEGLRA3
SCHEMBL28582930 0.82 LDHA (0.45) LDHALDHBCYP3A4ACHEGLRA3
SCHEMBL4124451 0.82 LDHA (0.50) LDHALDHBCYP3A4ACHEGLRA3

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
US-20120048295-A1 CLEANING FORMULATION FOR REMOVING RESIDUES ON SURFACES FUJIFILM ELECTRONIC MATERIALS U.S.A., INC. (US) 2012-03-01 US disclosed