SCHEMBL9680089

SCHEMBL9680089

Oc1ccc(C=Cc2ccc(-c3ccc(C=Cc4ccc(O)cc4)cc3)cc2)cc1

nearest known ligand 0.82

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 3/20 0.65
ESR2 Q92731 1/20 0.65
APP P05067 6/20 0.64
KDM4E B2RXH2 3/20 0.64
ALDH1A1 P00352 3/20 0.64
MAPT P10636 3/20 0.64
CYP2C9 P11712 3/20 0.64
CA12 O43570 2/20 0.64
CA1 P00915 2/20 0.64
CA2 P00918 2/20 0.64
CA3 P07451 2/20 0.64
CA4 P22748 2/20 0.64
CA6 P23280 2/20 0.64
CA5A P35218 2/20 0.64
CA7 P43166 2/20 0.64
CA9 Q16790 2/20 0.64
CA13 Q8N1Q1 2/20 0.64
CA14 Q9ULX7 2/20 0.64
CA5B Q9Y2D0 2/20 0.64
MEN1 O00255 2/20 0.64

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
SCHEMBL9680087 1.00 ESR1 (0.65) ESR1ESR2APPKDM4EALDH1A1
SCHEMBL6266987 0.91 APP (0.74) ESR1ESR2APPKDM4EALDH1A1
SCHEMBL9678787 0.91 APP (0.74) ESR1ESR2APPKDM4EALDH1A1
SCHEMBL9678794 0.91 APP (0.74) ESR1ESR2APPKDM4EALDH1A1
SCHEMBL6266989 0.91 APP (0.74) ESR1ESR2APPKDM4EALDH1A1
Trans-4,4'-Dihydroxystilbene SCHEMBL145659 0.91 APP (0.74) ESR1ESR2APPKDM4EALDH1A1
SCHEMBL6266983 0.91 APP (0.74) ESR1ESR2APPKDM4EALDH1A1
Trans-4,4'-Dihydroxystilbene SCHEMBL13339135 0.91 APP (0.74) ESR1ESR2APPKDM4EALDH1A1
Trans-4,4'-Dihydroxystilbene SCHEMBL491346 0.91 APP (0.74) ESR1ESR2APPKDM4EALDH1A1
SCHEMBL14173987 0.86 APP (0.61) ESR1ESR2APPKDM4EALDH1A1

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-5136013-A Polyesters BAYER AKTIENGESELLSCHAFT (DE) 1992-08-04 US disclosed
EP-0391204-A2 Process for preparing moulded articles of polymers with E-configurated stilbene moieties BAYER AG (DE) 1990-10-10 EP disclosed