SCHEMBL9862313

SCHEMBL9862313

CCC(Oc1ccc(OC)c(OC)c1OC)C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.47
PPARA Q07869 4/20 0.46
MAPT P10636 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
TSHR P16473 1/20 0.43
LDHA P00338 1/20 0.41
KDM4E B2RXH2 2/20 0.40
HSD17B10 Q99714 1/20 0.40
KMT2A Q03164 1/20 0.40
PPARG P37231 3/20 0.39
ABCG2 Q9UNQ0 1/20 0.39
ACHE P22303 1/20 0.39
PTGDR2 Q9Y5Y4 1/20 0.39
AOC3 Q16853 1/20 0.38
MAPK1 P28482 1/20 0.38

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
SCHEMBL4650644 0.81 KMT2A (0.62) SMN1; SMN2PPARATSHRKMT2APPARG
SCHEMBL8935639 0.81 KMT2A (0.62) SMN1; SMN2PPARATSHRKMT2APPARG
SCHEMBL8326074 0.78 GAA (0.50) SMN1; SMN2PPARAMAPTTSHRLDHA
SCHEMBL9862211 0.77 KMT2A (0.66) MAPTTDP1TSHRLDHAKDM4E
SCHEMBL8386814 0.77 LDHA (0.54) SMN1; SMN2PPARALDHAPPARGACHE
SCHEMBL2561624 0.77 TSHR (0.49) SMN1; SMN2PPARAMAPTTSHRKMT2A
SCHEMBL4877555 0.76 ALDH1A1 (0.57) SMN1; SMN2MAPTTDP1TSHRKDM4E
SCHEMBL6098435 0.76 ALDH1A1 (0.47) SMN1; SMN2KDM4EHSD17B10KMT2AMAPK1
SCHEMBL1565827 0.76 PPARG (0.46) SMN1; SMN2PPARATSHRKMT2APPARG
SCHEMBL5707514 0.75 TSHR (0.45) SMN1; SMN2PPARATSHRKMT2APPARG

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
US-5045336-A Reducing sweet taste of high sugar foods, organic acids and acid salts AMSTAR SUGAR CORPORATION (US) 1991-09-03 US disclosed
EP-0159864-B1 METHOD OF MODIFYING TASTE TATE & LYLE PUBLIC LIMITED COMPANY (GB) 1989-07-19 EP disclosed
EP-0159864-A2 Method of modifying taste TATE & LYLE PUBLIC LIMITED COMPANY (GB) 1985-10-30 EP disclosed