SCHEMBL285683

SCHEMBL285683

CC(C)C(Cc1ccc(O)cc1)c1ccc(O)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 15/20 0.64
ESR2 Q92731 14/20 0.64
TAAR1 Q96RJ0 3/20 0.55
SLC6A2 P23975 2/20 0.55
CYP1A2 P05177 2/20 0.54
CYP3A4 P08684 2/20 0.54
CYP2C9 P11712 2/20 0.54
CYP2C19 P33261 2/20 0.54
LMNA P02545 1/20 0.54
PGR P06401 1/20 0.54
CHRM2 P08172 1/20 0.54
ADORA3 P0DMS8 1/20 0.54
AR P10275 1/20 0.54
CYP2D6 P10635 1/20 0.54
MAPT P10636 1/20 0.54
CHRM1 P11229 1/20 0.54
ALOX15 P16050 1/20 0.54
DRD1 P21728 1/20 0.54
TBXA2R P21731 1/20 0.54
PTGS1 P23219 1/20 0.54

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
SCHEMBL30453326 0.87 ESR1 (0.61) ESR1ESR2TAAR1SLC6A2CYP1A2
SCHEMBL24186779 0.82 ESR1 (0.59) ESR1ESR2TAAR1SLC6A2CYP1A2
SCHEMBL18382530 0.81 ESR1 (0.56) ESR1ESR2TAAR1SLC6A2CYP1A2
SCHEMBL4241472 0.81 ESR1 (0.55) ESR1ESR2TAAR1SLC6A2CYP1A2
SCHEMBL20673669 0.80 TAAR1 (0.67) ESR1ESR2TAAR1SLC6A2CYP1A2
SCHEMBL20673668 0.80 TAAR1 (0.67) ESR1ESR2TAAR1SLC6A2CYP1A2
SCHEMBL16093258 0.79 ESR1 (0.64) ESR1ESR2TAAR1SLC6A2CYP1A2
SCHEMBL547164 0.78 ESR1 (1.00) ESR1ESR2TAAR1SLC6A2CYP1A2
SCHEMBL296781 0.78 ESR1 (1.00) ESR1ESR2TAAR1SLC6A2CYP1A2
SCHEMBL12872219 0.78 ESR1 (0.58) ESR1ESR2TAAR1SLC6A2CYP1A2

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
EP-2427511-B1 USE OF A POLYESTER FOR PRODUCTION OF MOULDED PARTS HAVING A LOW CONTENT OF ELUTABLE COMPONENTS BASF SE (DE) 2013-04-03 EP disclosed
EP-2427511-A1 USING A POLYESTER FOR PRODUCING MOLDED PARTS HAVING A LOW CONTENT OF EXTRACTABLE COMPOUNDS BASF SE (DE) 2012-03-14 EP disclosed
WO-2010128052-A1 USING A POLYESTER FOR PRODUCING MOLDED PARTS HAVING A LOW CONTENT OF EXTRACTABLE COMPOUNDS BASF SE (DE) 2010-11-11 WO disclosed
WO-2007017494-A1 IMPROVED PRODUCTION OF POLYESTERS BASF AKTIENGESELLSCHAFT (DE) 2007-02-15 WO disclosed
US-3933957-A Process for producing shaped articles from an acetylenic polymer GENERAL ELECTRIC COMPANY (US) 1976-01-20 US disclosed