SCHEMBL19902003

SCHEMBL19902003

CCC(Cc1cc(O)ccc1O)c1ccc(O)cc1O

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TYR P14679 5/20 0.40
BCHE P06276 1/20 0.39
ACHE P22303 1/20 0.39
GABRA1 P14867 1/20 0.39
GABRB2 P47870 1/20 0.39
ESR1 P03372 1/20 0.39
ESR2 Q92731 1/20 0.39
EGFR P00533 1/20 0.38
MEN1 O00255 1/20 0.37
TP53 P04637 1/20 0.37
CYP3A4 P08684 1/20 0.37
ALOX5 P09917 1/20 0.37
MAPT P10636 1/20 0.37
ALOX15 P16050 1/20 0.37
TSHR P16473 1/20 0.37
HTT P42858 1/20 0.37
KMT2A Q03164 1/20 0.37
TDP1 Q9NUW8 1/20 0.37

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
SCHEMBL29492305 0.84 TYR (0.48) TYRBCHEACHEESR1ESR2
SCHEMBL21830477 0.84 TYR (0.48) TYRBCHEACHEESR1ESR2
SCHEMBL4289027 0.79 TYR (0.46) TYRGABRA1GABRB2EGFR
SCHEMBL28970952 0.79 TYR (0.50) TYRBCHEACHEESR1ESR2
SCHEMBL19902004 0.78 ESR1 (0.44) GABRA1GABRB2ESR1ESR2EGFR
SCHEMBL28723259 0.77 TYR (0.43) TYRBCHEACHEESR1ESR2
SCHEMBL18888736 0.77 TYR (0.41) TYRESR1ESR2MEN1TP53
SCHEMBL19007298 0.76 TYR (0.42) TYRBCHEACHEESR1ESR2
SCHEMBL11673857 0.74 HTR2A (0.42) TYRGABRA1GABRB2EGFRTDP1
SCHEMBL4735401 0.74 GABRA1 (0.42) TYRGABRA1GABRB2ESR1ESR2

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-9902798-B2 Compound containing phenolic hydroxyl group, phenolic resin, curable composition, cured product thereof, semiconductor sealing material, and printed circuit board DIC CORPORATION (JP) 2018-02-27 US disclosed