SCHEMBL11366349

SCHEMBL11366349

C=CCc1cc(CO)cc(CO)c1OC

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.59
CYP3A4 P08684 3/20 0.44
ALOX15 P16050 2/20 0.44
ALDH1A1 P00352 3/20 0.40
ALOX5 P09917 3/20 0.40
PTGS1 P23219 2/20 0.40
DHFR P00374 1/20 0.40
AR P10275 1/20 0.40
TRPM8 Q7Z2W7 1/20 0.40
PPARG P37231 1/20 0.40
PPARD Q03181 1/20 0.40
PPARA Q07869 1/20 0.40
TP53 P04637 1/20 0.39
TSHR P16473 1/20 0.39
ALOX12 P18054 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
GABRA1 P14867 3/20 0.38
GABRB2 P47870 3/20 0.38
CNR2 P34972 2/20 0.38
POLB P06746 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
SCHEMBL27695787 0.87 MAPT (0.74) MAPTCYP3A4ALOX15TSHRPDE4A
SCHEMBL770139 0.83 ALDH1A1 (0.50) CYP3A4ALOX15ALDH1A1ALOX5PTGS1
SCHEMBL14193724 0.77 MAPT (0.60) MAPTDHFRPDE4APDE4BPDE4C
SCHEMBL8451613 0.77 CYP3A4 (0.51) CYP3A4ALOX15ALDH1A1ALOX5PTGS1
SCHEMBL4877224 0.76 GABRA1 (0.60) MAPTCYP3A4ALDH1A1ALOX5PTGS1
SCHEMBL1841607 0.76 MAPT (0.65) MAPTPDE4APDE4BPDE4CPDE4D
SCHEMBL17491870 0.75 TNKS (0.54) MAPTCYP3A4ALOX15ALDH1A1ALOX5
SCHEMBL9701610 0.75 CYP3A4 (0.44) CYP3A4ALOX15ALDH1A1ALOX5PTGS1
SCHEMBL5879482 0.75 CYP3A4 (0.50) CYP3A4ALOX15ALDH1A1ALOX5PTGS1
SCHEMBL2687511 0.75 KDM4E (0.45) MAPTALDH1A1ALOX5DHFRPPARG

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-4256844-A WATERPROOFING; PROTECTIVE COATINGS, FOAM IMPREGNATION; CONSTRUCTION MATERIALS THE DOW CHEMICAL COMPANY (US) 1981-03-17 US disclosed
US-4164487-A SOLVENT-RESISTANT, FLEXIBLE COATINGS THE DOW CHEMICAL COMPANY (US) 1979-08-14 US disclosed