SCHEMBL76962

SCHEMBL76962

CCCCCCCCCCCCCCCCCCN[C]=O

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 9/20 0.48
ADH1B P00325 1/20 0.48
ADH1C P00326 1/20 0.48
ADH1A P07327 1/20 0.48
ADH4 P08319 1/20 0.48
ADH7 P40394 1/20 0.48
TSHR P16473 2/20 0.46
ALDH1A1 P00352 1/20 0.46
PPARA Q07869 2/20 0.43
THRB P10828 1/20 0.42
CASP2 P42575 1/20 0.41
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.40
S1PR2 O95136 2/20 0.39
S1PR4 O95977 2/20 0.39
S1PR1 P21453 2/20 0.39
S1PR3 Q99500 2/20 0.39

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
SCHEMBL4621467 1.00 EPHX1 (0.48) EPHX1ADH1BADH1CADH1AADH4
SCHEMBL58362 1.00
SCHEMBL149027 1.00 EPHX1 (0.48) EPHX1ADH1BADH1CADH1AADH4
SCHEMBL11109100 1.00 EPHX1 (0.48) EPHX1ADH1BADH1CADH1AADH4
SCHEMBL10873634 1.00 EPHX1 (0.48) EPHX1ADH1BADH1CADH1AADH4
SCHEMBL146003 1.00 EPHX1 (0.48) EPHX1ADH1BADH1CADH1AADH4
SCHEMBL148471 1.00 EPHX1 (0.48) EPHX1ADH1BADH1CADH1AADH4
SCHEMBL10874788 1.00 EPHX1 (0.48) EPHX1ADH1BADH1CADH1AADH4
SCHEMBL9661841 1.00 EPHX1 (0.48) EPHX1ADH1BADH1CADH1AADH4
SCHEMBL305122 1.00 EPHX1 (0.48) EPHX1ADH1BADH1CADH1AADH4

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

Appears in 2030 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1189891-A1 TRIAZOLE COMPOUNDS AND COMBINATORIAL LIBRARIES THEREOF LION Bioscience AG (DE) 2002-03-27 EP claimed
US-6362342-B1 BIOSYNTHESIS; DRUG LIBRARIES LION BIOSCIENCE AG (DE) 2002-03-26 US claimed
WO-2001000594-A1 TRIAZOLE COMPOUNDS AND COMBINATORIAL LIBRARIES THEREOF LION BIOSCIENCE AG (DE) 2001-01-04 WO claimed
US-5976756-A EXPOSURE TO LIGHT A COLOR DIFFUSION TRANSFER SILVER HALIDE EMULSION FUJI PHOTO FILM, CO., LTD. (JP) 1999-11-02 US claimed
EP-0434079-B1 N,N'-hydrocarbylenebis(N-hals-substituted amic acid hydrazides) and their derivatives ATOCHEM NORTH AMERICA (US) 1995-09-20 EP claimed
EP-0157609-B1 LIPID DERIVATIVES THEIR PRODUCTION AND USE Takeda Chemical Industries, Ltd. (JP) 1992-10-14 EP claimed
US-5043372-A Light stabilizers for polyolefins; reacting hydrazine with bis(half ester-half amide) ATOCHEM NORTH AMERICA, INC. (US) 1991-08-27 US claimed
EP-0434079-A1 N,N'-hydrocarbylenebis(N-hals-substituted amic acid hydrazides) and their derivatives ELF ATOCHEM NORTH AMERICA, INC. (US) 1991-06-26 EP claimed
US-5025005-A Preventive or therapeutic agents for circulatory diseases, allergic disorders; antineoplastic agent; inhibitor for platelet activating factor TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1991-06-18 US claimed
US-4845219-A ANTITUMOR, ANTOCOAGULANT TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1989-07-04 US claimed
EP-0225129-B1 PHOSPHOLIPID DERIVATIVES, THEIR PRODUCTION AND USE Takeda Chemical Industries, Ltd. (JP) 1989-05-24 EP claimed
US-4778912-A ANTITUMOR AGENTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1988-10-18 US claimed
US-4737518-A ANTIALLERGENS, ANTINEOPLASTICS, ANTICOAGULANTS, CIRCULATORY DISEASES TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1988-04-12 US claimed
EP-0255366-A2 Nitrogen- and sulfur-containing lipid compound, their production and use Takeda Chemical Industries, Ltd. (JP) 1988-02-03 EP claimed
EP-0094186-B1 GLYCEROL DERIVATIVES, THEIR PRODUCTION AND USE Takeda Chemical Industries, Ltd. (JP) 1986-07-30 EP claimed
US-4576933-A Method of use of 1-(alkyl for alkylcarbanoyl)-2-carbamoylglycerol derivatives TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1986-03-18 US claimed
EP-0157609-A2 Lipid derivatives their production and use Takeda Chemical Industries, Ltd. (JP) 1985-10-09 EP claimed
EP-0094186-A1 Glycerol derivatives, their production and use Takeda Chemical Industries, Ltd. (JP) 1983-11-16 EP claimed
CN-110579936-B Thermally developable photosensitive material and medical film using the same 柯尼卡美能达株式会社 2023-10-27 CN disclosed
US-3930866-A MAGENTA FUJI PHOTO FILM CO., LTD. (JA) 1976-01-06 US disclosed