SCHEMBL10774718

SCHEMBL10774718

CC(c1ccc(O)cc1)(c1ccc(O)cc1)c1ccc2c(ccc3ccccc32)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 5/20 0.56
▸ ESR2 Q92731 5/20 0.56
▸ ALDH1A1 P00352 4/20 0.44
▸ HSD17B10 Q99714 3/20 0.44
▸ CYP1B1 Q16678 2/20 0.44
▸ HIF1A Q16665 1/20 0.44
▸ MAPT P10636 2/20 0.44
▸ HPGD P15428 2/20 0.44
▸ CYP3A4 P08684 2/20 0.43
▸ HPRT1 P00492 1/20 0.42
▸ MEN1 O00255 3/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ TDP1 Q9NUW8 2/20 0.41
▸ LMNA P02545 2/20 0.41
▸ GAA P10253 2/20 0.41
▸ ALPL P05186 1/20 0.41
▸ HSP90AA1 P07900 1/20 0.41
▸ ALPI P09923 1/20 0.41
▸ ALPG P10696 1/20 0.41
▸ CASP3 P42574 1/20 0.41

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
SCHEMBL10776933 0.92 ESR1 (0.58) ESR1ESR2ALDH1A1HSD17B10CYP1B1
SCHEMBL237505 0.86 ESR1 (0.64) ESR1ESR2ALDH1A1HSD17B10HPGD
SCHEMBL29672349 0.86 ESR1 (0.64) ESR1ESR2ALDH1A1HSD17B10HPGD
SCHEMBL9652624 0.79 ESR1 (0.50) ESR1ESR2ALDH1A1HSD17B10HPGD
SCHEMBL10409091 0.78 ALDH1A1 (0.54) ALDH1A1HSD17B10CYP1B1HIF1AMAPT
SCHEMBL13704988 0.77 HPRT1 (0.52) ALDH1A1HSD17B10CYP1B1HIF1AMAPT
Chloromethane SCHEMBL27456884 0.77 HPRT1 (0.56) ALDH1A1HSD17B10CYP1B1HIF1AMAPT
SCHEMBL15112169 0.76 HSD17B10 (0.67) ESR1ESR2ALDH1A1HSD17B10HIF1A
SCHEMBL29465780 0.76 ESR1 (0.55) ESR1ESR2ALDH1A1HSD17B10HIF1A
SCHEMBL69822 0.76 ESR1 (0.55) ESR1ESR2ALDH1A1HSD17B10HIF1A

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-4707464-A Recording material FUJI PHOTO FILM CO., LTD. (JP) 1987-11-17 — — US disclosed
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