SCHEMBL30429113

SCHEMBL30429113

COc1cc(C=CC(=O)OC2OC(CO)C(O)C(O)C2OC(=O)C=Cc2cc(OC)c(O)c(OC)c2)cc(OC)c1O

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ LDHA P00338 1/20 0.58
▸ EPHX2 P34913 3/20 0.55
▸ SNCA P37840 1/20 0.54
▸ PTPN1 P18031 1/20 0.52
▸ CA12 O43570 4/20 0.50
▸ CA9 Q16790 4/20 0.50
▸ CA1 P00915 3/20 0.50
▸ CA2 P00918 2/20 0.50
▸ PTGS1 P23219 3/20 0.49
▸ MET P08581 3/20 0.48
▸ ALOX5 P09917 1/20 0.48
▸ PRKCA P17252 2/20 0.47
▸ CYP1A2 P05177 1/20 0.47
▸ CYP3A4 P08684 1/20 0.47
▸ CYP2D6 P10635 1/20 0.47
▸ CYP2C9 P11712 1/20 0.47
▸ CYP2B6 P20813 1/20 0.47
▸ PKM P14618 1/20 0.46
▸ PTGS2 P35354 1/20 0.46

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
SCHEMBL26485996 1.00 LDHA (0.58) LDHAEPHX2SNCAPTPN1CA12
SCHEMBL2928116 1.00 LDHA (0.58) LDHAEPHX2SNCAPTPN1CA12
SCHEMBL30040193 0.94 LDHA (0.57) LDHAEPHX2SNCAPTPN1CA12
SCHEMBL30040229 0.92 LDHA (0.60) LDHAEPHX2SNCAPTPN1CA12
SCHEMBL30192596 0.91 LDHA (0.65) LDHAEPHX2SNCAPTPN1CA12
SCHEMBL546910 0.91 LDHA (0.65) LDHAEPHX2SNCAPTPN1CA12
SCHEMBL546911 0.91 LDHA (0.65) LDHAEPHX2SNCAPTPN1CA12
SCHEMBL15711524 0.91 LDHA (0.65) LDHAEPHX2SNCAPTPN1CA12
SCHEMBL30039394 0.88 PTPN1 (0.57) LDHAEPHX2SNCAPTPN1CA12
SCHEMBL30039672 0.87 PRKCA (0.57) LDHAEPHX2SNCAPTPN1CA12

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-20230136465-A1 PLANT-BASED CHICKEN FLAVORING AGENT COMPOSITION NotCo Delaware AI, LLC 2023-05-04 — — US disclosed
Send feedback