SCHEMBL4065601

SCHEMBL4065601

NCC(=O)C(=O)Oc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.42
ATM Q13315 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
ALOX15 P16050 2/20 0.42
HPGD P15428 1/20 0.41
HSD17B10 Q99714 1/20 0.41
ADRA2C P18825 1/20 0.41
CYP19A1 P11511 1/20 0.41
HDAC1 Q13547 1/20 0.40
HDAC2 Q92769 1/20 0.40
ELANE P08246 1/20 0.40
PRSS1 P07477 1/20 0.39
PRSS2 P07478 1/20 0.39
PRSS3 P35030 1/20 0.39
PARP10 Q53GL7 2/20 0.39
MAPT P10636 2/20 0.39
KDM4E B2RXH2 1/20 0.39
NSD2 O96028 1/20 0.39
TAAR1 Q96RJ0 1/20 0.39
SMN1; SMN2 Q16637 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
Water SCHEMBL27685948 0.98 TDP1 (0.41) TDP1ATML3MBTL1ALOX15HPGD
SCHEMBL58882 0.81 TDP1 (0.44) TDP1ATML3MBTL1ALOX15HPGD
SCHEMBL27497732 0.80 ELANE (0.45) TDP1ATML3MBTL1ALOX15HPGD
SCHEMBL8069670 0.80 MAPT (0.46) TDP1ATML3MBTL1HSD17B10ELANE
Diphenyl Ethanedioat SCHEMBL43364 0.79 TDP1 (0.54) TDP1ATML3MBTL1ALOX15HPGD
SCHEMBL11033789 0.79 TDP1 (0.42) TDP1ATML3MBTL1ALOX15HPGD
SCHEMBL237447 0.79 CES2 (0.50) TDP1ATML3MBTL1ALOX15HPGD
SCHEMBL17371826 0.79 TDP1 (0.42) TDP1ATML3MBTL1ALOX15HPGD
SCHEMBL27491574 0.79 TDP1 (0.42) TDP1ATML3MBTL1ALOX15HPGD
SCHEMBL11569510 0.79 ALOX15 (0.47) TDP1ATML3MBTL1ALOX15HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1490483-A2 IN VIVO INCORPORATION OF UNNATURAL AMINO ACIDS The Scripps Research Institute (US) 2004-12-29 EP claimed
WO-2002085923-A2 IN VIVO INCORPORATION OF UNNATURAL AMINO ACIDS THE SCRIPPS RESEARCH INSTITUTE (US) 2002-10-31 WO claimed
EP-2649457-B1 IMMUNOASSAY FOR THROMBIN DETECTION OMRIX BIOPHARMACEUTICALS LTD (IL) 2016-06-29 EP disclosed
CN-103597006-A Photochromic polymers ADVANCED POLYMERIK PTY LTD 2014-02-19 CN disclosed
CN-102459378-B Stain-proofing composition, stain-proofing film, stain-proofing laminate film, transfer film, resin laminate, and method for producing resin laminate MITSUBISHI RAYON CO 2014-01-01 CN disclosed
CN-102076733-B Epoxy resin composition THREE BOND CO LTD 2013-10-09 CN disclosed
CN-1880381-B Process for the production of pigment composition, colored composition for color filter obtained by said process, and color filter TOYO INK MFG CO 2013-09-18 CN disclosed
CN-102449009-B Curable silicone resin composition YOKOHAMA RUBBER CO LTD 2013-07-24 CN disclosed
CN-103168050-A Semi-cured product, and methods for producing same, optical member, and curable resin composition FUJIFILM CORP 2013-06-19 CN disclosed
CN-103097436-A Resin composition NAMICS CORP 2013-05-08 CN disclosed
CN-101563300-B Glass substrates coated or laminated with cured silicone resin compositions DOW CORNING 2012-09-05 CN disclosed
CN-1639285-A Flexible Coatings for Elastomeric Substrates LORD CORP (US) 2005-07-13 CN disclosed
EP-1490483-A2 IN VIVO INCORPORATION OF UNNATURAL AMINO ACIDS The Scripps Research Institute (US) 2004-12-29 EP disclosed
US-20040214274-A1 Transformants producing substance pf1022 derivatives, methods for producing the same, and novel biosynthesis genes MEIJI SEIKA KAISHA, LTD. (JP) 2004-10-28 US disclosed
CN-1514848-A Curable unsaturated resin composition 大日本油墨化学工业株式会社 2004-07-21 CN disclosed
CN-1156540-C A method of coating a substrate ����װ��عɹɷݹ�˾ 2004-07-07 CN disclosed
EP-1380649-A1 TRANSFORMANT PRODUCING PF1022 SUBSTANCE DERIVATIVES, PROCESS FOR PRODUCING THE SAME AND NOVEL BIOSYNTHESIS GENE MEIJI SEIKA KAISHA LTD. (JP) 2004-01-14 EP disclosed
CN-1461394-A Light source device MITSUBISHI RAYON CO (JP) 2003-12-10 CN disclosed
WO-2002085923-A2 IN VIVO INCORPORATION OF UNNATURAL AMINO ACIDS THE SCRIPPS RESEARCH INSTITUTE (US) 2002-10-31 WO disclosed
CN-1268157-A A method of coating a substrate PERSTORP AB (SE) 2000-09-27 CN disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040214274-A1 Transformants producing substance pf1022 derivatives, methods for producing the same, and novel biosynthesis genes GFPT1, FDPS, PSAT1 TDP1 2690/4885ATM 2471/4885L3MBTL1 2944/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.