SCHEMBL3764165

SCHEMBL3764165

BrCc1ccc(CBr)c(-c2ccccc2)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.44
TRPA1 O75762 1/20 0.44
TSHR P16473 1/20 0.44
BACE1 P56817 2/20 0.40
CSNK2A1 P68400 2/20 0.38
CES2 O00748 1/20 0.37
CES1 P23141 1/20 0.37
DPP4 P27487 1/20 0.36
MAPK1 P28482 1/20 0.35
TAAR1 Q96RJ0 2/20 0.35
PTPN1 P18031 2/20 0.35
FOLH1 Q04609 1/20 0.35
PTPN2 P17706 1/20 0.35
PTPN6 P29350 1/20 0.35
GSTP1 P09211 1/20 0.34
FFAR1 O14842 1/20 0.34
FFAR4 Q5NUL3 1/20 0.34
SMARCA2 P51531 1/20 0.33
SMARCA4 P51532 1/20 0.33
PBRM1 Q86U86 1/20 0.33

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
SCHEMBL29712511 0.84 ALDH1A1 (0.44) ALDH1A1TRPA1TSHRBACE1CSNK2A1
SCHEMBL1373277 0.83 ALDH1A1 (0.48) ALDH1A1TRPA1TSHRBACE1CSNK2A1
SCHEMBL15075513 0.80 ALDH1A1 (0.50) ALDH1A1TRPA1TSHRBACE1CSNK2A1
SCHEMBL2779989 0.78 CSNK2A1 (0.49) ALDH1A1TRPA1TSHRBACE1CSNK2A1
SCHEMBL31163822 0.76 DPP4 (0.60) ALDH1A1TRPA1TSHRBACE1DPP4
SCHEMBL471 0.76 DPP4 (0.60) ALDH1A1TRPA1TSHRBACE1DPP4
SCHEMBL9215325 0.76 ALDH1A1 (0.44) ALDH1A1TRPA1TSHRBACE1CSNK2A1
SCHEMBL4664590 0.76 ALDH1A1 (0.41) ALDH1A1TRPA1TSHRCSNK2A1CES2
SCHEMBL3139862 0.76 METAP2 (0.42) ALDH1A1TRPA1TSHR
SCHEMBL1309773 0.75 ALDH1A1 (0.48) ALDH1A1TRPA1TSHRCES2CES1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4493735-B2 2010-06-30 JP claimed
EP-0975710-B2 POLYMER ELECTROLUMINESCENT DEVICE MERCK PATENT GMBH (DE) 2009-06-10 EP claimed
EP-0975710-B1 POLYMER ELECTROLUMINESCENT DEVICE KONINKL PHILIPS ELECTRONICS NV (NL) 2003-09-10 EP claimed
EP-1310540-A1 Polymer electroluminescent device Koninklijke Philips Electronics N.V. (NL) 2003-05-14 EP claimed
US-20020001732-A1 POLYMER ELECTROLUMINESCENT DEVICE U.S. PHILIPS CORPORATION 2002-01-03 US claimed
JP-2001507511-A 2001-06-05 JP claimed
EP-0975710-A1 POLYMER ELECTROLUMINESCENT DEVICE Koninklijke Philips Electronics N.V. (NL) 2000-02-02 EP claimed
WO-1999021936-A1 POLYMER ELECTROLUMINESCENT DEVICE KONINKLIJKE PHILIPS ELECTRONICS N.V. (NL) 1999-05-06 WO claimed
US-8377570-B2 Poly(arylenevinylene) and poly(heteroarylenevinylene) light emitting polymer and polymer light-emitting devices AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2013-02-19 US disclosed
EP-0975710-B2 POLYMER ELECTROLUMINESCENT DEVICE MERCK PATENT GMBH (DE) 2009-06-10 EP disclosed
US-20080272691-A1 Poly(Arylenevinylene) and Poly(Heteroarylenevinylene) Light Emitting Polymers and Polymer Light-Emitting Devices AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2008-11-06 US disclosed
EP-0975710-B1 POLYMER ELECTROLUMINESCENT DEVICE KONINKL PHILIPS ELECTRONICS NV (NL) 2003-09-10 EP disclosed
EP-1310540-A1 Polymer electroluminescent device Koninklijke Philips Electronics N.V. (NL) 2003-05-14 EP disclosed
US-6458909-B1 SOLID-STATE LIGHT SOURCES FOR A SERIES OF APPLICATIONS, PREDOMINANTLY IN THE FIELD OF DISPLAY ELEMENTS HOECHST AKTIENGESELLSCHAFT (DE) 2002-10-01 US disclosed
US-4161607-A Thermally stable, rigid bisphenols E. I. DU PONT DE NEMOURS AND COMPANY (US) 1979-07-17 US disclosed
US-4107444-A INTERMEDIATES FOR POLYESTERS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1978-08-15 US disclosed
US-4096341-A MONOMERS FOR POLYESTERS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1978-06-20 US disclosed
US-4085091-A Thermally stable, rigid polyesters from thermally stable, rigid dibasic acids and aromatic dihydroxy compounds E. I. DUPONT DE NEMOURS AND COMPANY (US) 1978-04-18 US disclosed
US-4065432-A Thermally stable, rigid polyesters from aromatic dibasic acids and thermally stable, rigid bisphenols E. I. DU PONT DE NEMOURS AND COMPANY (US) 1977-12-27 US disclosed
US-4065431-A Thermally stable, rigid polyesters from aromatic dibasic acids and thermally stable, rigid diols E. I. DU PONT DE NEMOURS AND COMPANY (US) 1977-12-27 US disclosed