SCHEMBL901666

SCHEMBL901666

CCOP(=O)(Cc1ccccc1Cl)OCC

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.41
ALDH1A1 P00352 2/20 0.41
NPSR1 Q6W5P4 1/20 0.41
IDO1 P14902 3/20 0.40
SLC6A2 P23975 1/20 0.40
SLC6A4 P31645 1/20 0.40
SLC6A3 Q01959 1/20 0.40
KCNH2 Q12809 1/20 0.40
PNMT P11086 1/20 0.39
EGFR P00533 1/20 0.39
TSHR P16473 1/20 0.39
TAAR1 Q96RJ0 2/20 0.38

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
SCHEMBL702504 0.87 NPSR1 (0.47) NPSR1KCNH2EGFRTSHR
SCHEMBL19904753 0.86 MEN1 (0.46) ALDH1A1IDO1PNMTTAAR1
SCHEMBL8958928 0.84 HSD17B10 (0.43) HSD17B10ALDH1A1NPSR1IDO1SLC6A2
SCHEMBL8958923 0.81 IDO1 (0.42) ALDH1A1IDO1SLC6A2SLC6A4SLC6A3
SCHEMBL13653125 0.81 PTGS2 (0.51) TSHR
SCHEMBL16513210 0.80 IDO1 (0.43) HSD17B10ALDH1A1NPSR1IDO1SLC6A2
SCHEMBL12212067 0.80 NPSR1 (0.42) ALDH1A1NPSR1KCNH2EGFRTSHR
SCHEMBL916350 0.80 CCNT1 (0.43) ALDH1A1NPSR1KCNH2EGFRTSHR
SCHEMBL5250114 0.80 SMN1; SMN2 (0.53) HSD17B10ALDH1A1NPSR1KCNH2TSHR
SCHEMBL10627650 0.79 TDP1 (0.46) IDO1EGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10103401-B2 Polymer electrolyte composition and polymer electrolyte membrane, polymer electrolyte membrane with catalyst layer, membrane electrode assembly, and polymer electrolyte fuel cell each using the same TORAY INDUSTRIES, INC. (JP) 2018-10-16 US disclosed
EP-3131145-B1 POLYMER ELECTROLYTE COMPOSITION AND POLYMER ELECTROLYTE MEMBRANE, MEMBRANE-ELECTROLYTE ASSEMBLY, AND SOLID POLYMER FUEL CELL USING SAME TORAY INDUSTRIES (JP) 2018-09-05 EP disclosed
US-9896479-B2 Functionalized naphthalene fluorophores Kay M. Brummond (US) 2018-02-20 US disclosed
US-9896479-B2 Functionalized naphthalene fluorophores Kay M. Brummond (US) 2018-02-20 US disclosed
US-9896479-B2 Functionalized naphthalene fluorophores Kay M. Brummond (US) 2018-02-20 US disclosed
CN-107709314-A Efflux pump inhibitor and its therapeutic use 巴斯利尔药物国际股份公司 2018-02-16 CN disclosed
US-20170125832-A1 POLYMER ELECTROLYTE COMPOSITION AND POLYMER ELECTROLYTE MEMBRANE, POLYMER ELECTROLYTE MEMBRANE WITH CATALYST LAYER, MEMBRANE ELECTRODE ASSEMBLY, AND POLYMER ELECTROLYTE FUEL CELL EACH USING THE SAME TORAY INDUSTRIES, INC. (JP) 2017-05-04 US disclosed
EP-3131145-A1 POLYMER ELECTROLYTE COMPOSITION AND POLYMER ELECTROLYTE MEMBRANE, MEMBRANE-ELECTROLYTE ASSEMBLY, AND SOLID POLYMER FUEL CELL USING SAME Toray Industries, Inc. (JP) 2017-02-15 EP disclosed
US-9512174-B2 Synthesis, structure and use of functionalized naphthalenes Brummond, Kay M. (US) 2016-12-06 US disclosed
US-9512174-B2 Synthesis, structure and use of functionalized naphthalenes Brummond, Kay M. (US) 2016-12-06 US disclosed
US-5510351-A PREGNANE ENZYME INHIBITOR FOR TREATING SKIN DISORDER, BALDNESS, PROSTATIC CANCER MERCK & CO., INC. (US) 1996-04-23 US disclosed
EP-0646007-A4 1995-04-26 EP disclosed
EP-0646007-A1 NEW DELTA-17 AND DELTA-20 OLEFINIC AND SATURATED 17-g(b)-SUBSTITUTED-4-AZA-5-g(a)-ANDROSTAN-3-ONES AS 5-g(a)-REDUCTASE INHIBITORS. MERCK & CO INC (US) 1995-04-05 EP disclosed
EP-0572166-A1 New 7beta-substituted-4-aza-5a-androstan-3-ones as 5a-reductase inhibitors MERCK & CO. INC. (US) 1993-12-01 EP disclosed
WO-1993023039-A1 SUBSTITUTED 4-AZA-5A-ANDROSTAN-ONES AS 5A-REDUCTASE INHIBITORS MERCK & CO., INC. (US) 1993-11-25 WO disclosed
WO-1993023420-A1 NEW 7β-SUBSTITUTED-4-AZA-5α-ANDROSTAN-3-ONES AS 5α-REDUCTASE INHIBITORS MERCK & CO., INC. (US) 1993-11-25 WO disclosed
WO-1993023050-A1 NEW DELTA-17 AND DELTA-20 OLEFINIC AND SATURATED 17β-SUBSTITUTED-4-AZA-5α-ANDROSTAN-3-ONES AS 5α-REDUCTASE INHIBITORS MERCK & CO., INC. (US) 1993-11-25 WO disclosed
US-5242908-A Of dna and rna HOECHST AKTIENGESELLSCHAFT (DE) 1993-09-07 US disclosed
CN-1053793-A Use the disease that benzylphosphonic acid derivatives for treatment is caused by virus HOECHST AG (DE) 1991-08-14 CN disclosed
EP-0440148-A1 Use of benzylphosphonic acid derivates for the treatment of viral diseases HOECHST AKTIENGESELLSCHAFT (DE) 1991-08-07 EP disclosed