SCHEMBL20925183

SCHEMBL20925183

CC(=O)c1cc(C(C)(c2ccc(O)cc2)c2ccc(O)c(C)c2)cc(C(C)(c2ccc(O)cc2)c2ccc(O)c(S)c2)c1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 10/20 0.48
▸ ESR2 Q92731 6/20 0.48
▸ BACE1 P56817 1/20 0.36
▸ AR P10275 2/20 0.35
▸ GAA P10253 2/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ PKM P14618 1/20 0.35
▸ ESRRG P62508 1/20 0.34
▸ HSD17B1 P14061 2/20 0.33
▸ CA5A P35218 1/20 0.33
▸ VDR P11473 1/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ KMT2A Q03164 1/20 0.32

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
SCHEMBL18643615 0.90 ESR1 (0.55) ESR1ESR2BACE1ARGAA
SCHEMBL21167288 0.90 ESR1 (0.55) ESR1ESR2BACE1ARGAA
SCHEMBL19884613 0.85 ESR1 (0.38) ESR1ESR2ARALDH1A1ESRRG
SCHEMBL12526572 0.82 ESR1 (0.52) ESR1ESR2ARALDH1A1ESRRG
SCHEMBL19884626 0.81 ESR1 (0.59) ESR1ESR2BACE1ARALDH1A1
SCHEMBL19842187 0.79 ESR1 (0.52) ESR1ESR2ARALDH1A1ESRRG
SCHEMBL5031065 0.78 ESR1 (0.75) ESR1ESR2BACE1ARALDH1A1
SCHEMBL20925211 0.77 ESR1 (0.65) ESR1ESR2ARALDH1A1ESRRG
SCHEMBL18643616 0.75 ESR1 (0.49) ESR1ESR2ARALDH1A1ESRRG
SCHEMBL9298912 0.74 ESR1 (0.74) ESR1ESR2ARGAAALDH1A1

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
EP-2505576-B1 CYCLIC COMPOUND, PROCESS FOR PRODUCTION THEREOF, RADIATION-SENSITIVE COMPOSITION, AND RESIST PATTERN FORMATION METHOD MITSUBISHI GAS CHEMICAL CO (JP) 2019-04-24 — — EP disclosed
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