SCHEMBL1133737

SCHEMBL1133737

CC(C)(c1ccc(O)cc1)c1cccc(O)c1C(C)(C)c1ccc(O)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 9/20 0.54
ESR2 Q92731 7/20 0.54
CYP3A4 P08684 2/20 0.54
TSHR P16473 2/20 0.54
HSD17B10 Q99714 2/20 0.54
AR P10275 1/20 0.54
HPGD P15428 1/20 0.54
SLC6A2 P23975 1/20 0.54
SLC6A4 P31645 1/20 0.54
HTR6 P50406 1/20 0.54
ESRRG P62508 1/20 0.54
SLC6A3 Q01959 1/20 0.54
ALDH1A1 P00352 3/20 0.52
LMNA P02545 2/20 0.43
TYR P14679 2/20 0.43
TDP1 Q9NUW8 1/20 0.41
CA2 P00918 1/20 0.38
SHBG P04278 1/20 0.37
NR1I2 O75469 1/20 0.34
CYP2C9 P11712 1/20 0.34

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
Propane SCHEMBL28317857 0.95 ESR1 (0.49) ESR1ESR2CYP3A4TSHRHSD17B10
SCHEMBL4639679 0.90 ESR1 (0.60) ESR1ESR2CYP3A4TSHRHSD17B10
SCHEMBL7751060 0.88 ESR1 (0.62) ESR1ESR2CYP3A4TSHRHSD17B10
SCHEMBL982955 0.87 ESR1 (0.48) ESR1ESR2CYP3A4TSHRHSD17B10
SCHEMBL18399476 0.84 ESR1 (0.45) ESR1ESR2CYP3A4TSHRHSD17B10
SCHEMBL18400659 0.84 ESR1 (0.45) ESR1ESR2CYP3A4TSHRHSD17B10
SCHEMBL177979 0.82 ESR1 (0.63) ESR1ESR2CYP3A4TSHRHSD17B10
SCHEMBL29446724 0.82 ESR1 (0.63) ESR1ESR2CYP3A4TSHRHSD17B10
Bicarbonate SCHEMBL29789005 0.82 ESR1 (0.44) ESR1ESR2CYP3A4TSHRALDH1A1
Bicarbonate SCHEMBL17164627 0.82 ESR1 (0.44) ESR1ESR2CYP3A4TSHRALDH1A1

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 33 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106103643-B Thermally conductive thermoplastic compounds with balanced machinability 科思创德国股份有限公司 2019-10-18 CN disclosed
CN-108884268-A Polycarbonate compositions containing isosorbide diesters 科思创德国股份有限公司 2018-11-23 CN disclosed
CN-105473342-B For secure file and/or the data page of valuable document 联邦印刷厂有限公司 2018-11-20 CN disclosed
CN-103269852-B Multi-layer plastic structure with low energy transmission 科思创德国股份有限公司 2018-09-04 CN disclosed
CN-104955880-B It is used to prepare the method for the ABS compositions after hot-wet storage with improved surface 科思创德国股份有限公司 2018-06-26 CN disclosed
CN-108137917-A Method for producing polycarbonate moulding materials with improved thermal processing stability 科思创德国股份有限公司 2018-06-08 CN disclosed
EP-3038838-A2 DATASHEET FOR A SECURITY AND/OR VALUABLE DOCUMENT Bundesdruckerei GmbH (DE) 2016-07-06 EP disclosed
EP-2569354-B1 POLYMER COMPOSITION HAVING HEAT-ABSORBENT PROPERTIES AND IMPROVED DYEING PROPERTIES BAYER IP GMBH (DE) 2015-07-22 EP disclosed
EP-2569356-B1 POLYMER COMPOSITION HAVING HEAT-ABSORBENT PROPERTIES AND HIGH STABILITY BAYER IP GMBH (DE) 2014-12-17 EP disclosed
EP-2569354-A1 POLYMER COMPOSITION HAVING HEAT-ABSORBENT PROPERTIES AND IMPROVED DYEING PROPERTIES Bayer Intellectual Property GmbH (DE) 2013-03-20 EP disclosed
WO-2002086839-A2 IMPACT RESISTANT MODIFIED BLENDS MADE OF POLYETHYLENTEREPHTHALATE AND AT LEAST ONE POLYCARBONATE BASED ON DIHYDROXYDIARYLCYCLOHEXANE BAYER AKTIENGESELLSCHAFT (DE) 2002-10-31 WO disclosed
WO-2002083412-A1 HEAT-ABSORBING LAYER SYSTEM BAYER AKTIENGESELLSCHAFT (DE) 2002-10-24 WO disclosed
EP-1232216-A1 COMPOSITIONS BASED ON SHOCK RESISTANCE-MODIFIED POLYETHYLENETEREPHTHALATE/POLYCARBONATE BLENDS Bayer Aktiengesellschaft (DE) 2002-08-21 EP disclosed
EP-1228129-A1 MOLDING MATERIALS Bayer Aktiengesellschaft (DE) 2002-08-07 EP disclosed
WO-2001034703-A1 COMPOSITIONS BASED ON SHOCK RESISTANCE-MODIFIED POLYETHYLENETEREPHTHALATE/POLYCARBONATE BLENDS BAYER AKTIENGESELLSCHAFT (DE) 2001-05-17 WO disclosed
EP-1095108-A1 COATINGS AGENT AND THE USE THEREOF BAYER AG (DE) 2001-05-02 EP disclosed
WO-2001018101-A1 MOLDING MATERIALS BAYER AKTIENGESELLSCHAFT (DE) 2001-03-15 WO disclosed
WO-2000000554-A1 COATINGS AGENT AND THE USE THEREOF BAYER AKTIENGESELLSCHAFT (DE) 2000-01-06 WO disclosed
EP-0387631-A2 Thermoplastic moulding compositions from polysiloxane-polycarbonate block copolymers, polycarbonates based on selected dihydroxydiphenylcycloalkanes and optionally elastomers BAYER AG (DE) 1990-09-19 EP disclosed
EP-0173146-B1 ACRYLONITRILE-FREE POLYCARBONATE BLEND BAYER AG (DE) 1988-03-02 EP disclosed