SCHEMBL3719178

SCHEMBL3719178

C/C=C/C(c1ccc(O)cc1)c1ccc(O)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 9/20 0.48
ESR2 Q92731 7/20 0.48
PDCD1 Q15116 1/20 0.48
CD274 Q9NZQ7 1/20 0.48
MAPT P10636 4/20 0.43
LMNA P02545 3/20 0.43
CYP3A4 P08684 3/20 0.43
ALOX15 P16050 3/20 0.43
CYP2C9 P11712 3/20 0.43
CYP1A2 P05177 2/20 0.43
ADORA3 P0DMS8 2/20 0.43
CYP2D6 P10635 2/20 0.43
CYP2C19 P33261 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
PGR P06401 1/20 0.43
CHRM2 P08172 1/20 0.43
AR P10275 1/20 0.43
CHRM1 P11229 1/20 0.43
DRD1 P21728 1/20 0.43
TBXA2R P21731 1/20 0.43

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
SCHEMBL109077 1.00 ESR1 (0.48) ESR1ESR2PDCD1CD274MAPT
SCHEMBL1082595 0.92 IDO1 (0.44) ESR1ESR2PDCD1CD274MAPT
SCHEMBL6981619 0.76 IDO1 (0.38) SLC6A2SLC6A3MEN1KMT2AGAA
SCHEMBL14220303 0.76 ESR1 (0.48) ESR1ESR2PDCD1CD274MAPT
SCHEMBL13827770 0.76 ESR1 (0.48) ESR1ESR2PDCD1CD274MAPT
SCHEMBL24026445 0.76 ESR1 (0.35) ESR1ESR2PDCD1CD274MAPT
SCHEMBL692130 0.75 MEN1 (0.39) LMNACYP2D6TDP1HIF1AMEN1
SCHEMBL8613849 0.75 MEN1 (0.39) LMNACYP2D6TDP1HIF1AMEN1
SCHEMBL10077146 0.74 ESR1 (0.43) ESR1ESR2PDCD1CD274MAPT
SCHEMBL13744449 0.74 ESR1 (0.52) ESR1ESR2PDCD1CD274MAPT

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115428128-A Hollow microspheres 株式会社德山 2022-12-02 CN disclosed
EP-2888324-A1 IMPROVED POLYCARBONATE COMPOSITIONS SABIC Global Technologies B.V. (NL) 2015-07-01 EP disclosed
WO-2014030133-A1 IMPROVED POLYCARBONATE COMPOSITIONS SABIC INNOVATIVE PLASTICS IP B.V. (NL) 2014-02-27 WO disclosed
WO-2010124147-A1 COMPOSITIONS AND METHODS FOR METHANE PRODUCTION QTEROS, INC. (US) 2010-10-28 WO disclosed
US-4746711-A LOW TENDENCY TO STRESS CRACKING BAYER AKTIENGESELLSCHAFT (DE) 1988-05-24 US disclosed