SCHEMBL20808564

SCHEMBL20808564

COc1cc(C(c2ccc(O)cc2)c2ccc(O)cc2)c(OC)cc1C(c1ccc(O)cc1)c1ccc(O)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.45
TSHR P16473 3/20 0.42
NPSR1 Q6W5P4 2/20 0.42
BLM P54132 1/20 0.42
ESR1 P03372 1/20 0.41
PDCD1 Q15116 1/20 0.41
ESR2 Q92731 1/20 0.41
CD274 Q9NZQ7 1/20 0.41
GAA P10253 3/20 0.41
ALDH1A1 P00352 2/20 0.41
KMT2A Q03164 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
BCHE P06276 1/20 0.41
TYR P14679 1/20 0.41
ACHE P22303 1/20 0.41
CYP3A4 P08684 3/20 0.40
MGAM O43451 2/20 0.40
SI P14410 2/20 0.40
MGAM2 Q2M2H8 2/20 0.40
MAPT P10636 2/20 0.40

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
SCHEMBL1758407 0.87 BCHE (0.44) MAOBTSHRNPSR1BLMESR1
SCHEMBL20808581 0.78 TSHR (0.45) MAOBTSHRNPSR1BLMGAA
SCHEMBL8768786 0.77 MAOB (0.62) MAOBTSHRNPSR1BLMGAA
SCHEMBL8146274 0.77 MAOB (0.62) MAOBTSHRNPSR1BLMGAA
SCHEMBL29375595 0.77 MAOB (0.62) MAOBTSHRNPSR1BLMGAA
SCHEMBL757257 0.77 MAOB (0.62) MAOBTSHRNPSR1BLMGAA
SCHEMBL3413913 0.77 MAOB (0.62) MAOBTSHRNPSR1BLMGAA
SCHEMBL22301884 0.77 GAA (0.46) MAOBTSHRGAAALDH1A1KMT2A
SCHEMBL22301838 0.76 CYP3A4 (0.44) ESR1ESR2GAAALDH1A1KMT2A
SCHEMBL20808568 0.74 ALOX5 (0.39) TSHRNPSR1BLMGAABCHE

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-20190077901-A1 NOVOLAC-TYPE PHENOLIC HYDROXY GROUP-CONTAINING RESIN, AND RESIST FILM DIC CORPORATION (JP) 2019-03-14 US disclosed