SCHEMBL598462

SCHEMBL598462

CC(=O)C(=O)Oc1ccc(N)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 6/20 0.44
MAPT P10636 3/20 0.44
MAPK1 P28482 1/20 0.44
KDM4E B2RXH2 1/20 0.44
GLA P06280 1/20 0.44
GAA P10253 1/20 0.44
THRB P10828 1/20 0.44
BLM P54132 1/20 0.44
CASP6 P55212 1/20 0.44
GFER P55789 1/20 0.44
PARP10 Q53GL7 1/20 0.44
LMNA P02545 1/20 0.43
CYP19A1 P11511 1/20 0.43
ALDH1A1 P00352 3/20 0.43
CYP3A4 P08684 2/20 0.43
TSHR P16473 2/20 0.42
PRSS1 P07477 3/20 0.42
PRSS2 P07478 3/20 0.42
PRSS3 P35030 3/20 0.42
F2 P00734 2/20 0.42

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
SCHEMBL4100461 0.86 TDP1 (0.50) TDP1MAPTMAPK1KDM4EGLA
SCHEMBL1263025 0.83 ELANE (0.59) TDP1MAPTMAPK1KDM4EGLA
SCHEMBL222240 0.82 LMNA (0.64) TDP1MAPTMAPK1KDM4EGLA
SCHEMBL1044505 0.80 LMNA (0.61) TDP1MAPTMAPK1KDM4EGLA
SCHEMBL11456568 0.80 LMNA (0.61) TDP1MAPTMAPK1KDM4EGLA
SCHEMBL6618980 0.80 CES2 (0.52) MAPTGAAPARP10LMNAALDH1A1
SCHEMBL4447324 0.80 LMNA (0.68) GAALMNAALDH1A1CYP3A4TSHR
SCHEMBL24158 0.80 ELANE (0.48) TDP1MAPTKDM4EGLAGAA
SCHEMBL27933475 0.80 PARP10 (0.50) TDP1MAPTMAPK1KDM4EGLA
Hydrochloric Acid SCHEMBL28309210 0.80 LMNA (0.61) TDP1MAPTMAPK1KDM4EGLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230392173-A1 ENGINEERED BIOSYNTHETIC PATHWAY FOR PRODUCTION OF 4-AMINOPHENYLETHYLAMINE BY FERMENTATION ZYMERGEN INC. (US) 2023-12-07 US claimed
CN-116368233-A Engineered biosynthetic pathway for the production of 4-aminophenylamine by fermentation 齐默尔根公司 2023-06-30 CN claimed
EP-4200430-A1 ENGINEERED BIOSYNTHETIC PATHWAY FOR PRODUCTION OF 4-AMINOPHENYLETHYLAMINE BY FERMENTATION Zymergen Inc. (US) 2023-06-28 EP claimed
WO-2022040457-A1 ENGINEERED BIOSYNTHETIC PATHWAY FOR PRODUCTION OF 4-AMINOPHENYLETHYLAMINE BY FERMENTATION ZYMERGEN INC. (US) 2022-02-24 WO claimed
CN-106471120-B Method for producing aniline derivatives from carbon sources by fermentation 国立研究开发法人科学技术振兴机构 2020-07-03 CN claimed
US-10655153-B2 Chemoenzymatic synthesis of peptide beta-lactones and beta-hydroxy acids WASHINGTON UNIVERSITY (US) 2020-05-19 US claimed
US-20180265905-A1 CHEMOENZYMATIC SYNTHESIS OF PEPTIDE BETA-LACTONES AND BETA-HYDROXY ACIDS WASHINGTON UNIVERSITY (US) 2018-09-20 US claimed
US-9920343-B2 Method for producing aniline derivative by fermentation from carbon source JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2018-03-20 US claimed
US-20170022528-A1 METHOD FOR PRODUCING ANILINE DERIVATIVE BY FERMENTATION FROM CARBON SOURCE JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2017-01-26 US claimed
EP-3121275-A1 METHOD FOR PRODUCING ANILINE DERIVATIVE BY FERMENTATION FROM CARBON SOURCE Japan Science and Technology Agency (JP) 2017-01-25 EP claimed
EP-1380649-B1 TRANSFORMANT PRODUCING PF1022 SUBSTANCE DERIVATIVES, PROCESS FOR PRODUCING THE SAME AND NOVEL BIOSYNTHESIS GENE MEIJI SEIKA KAISHA (JP) 2009-10-21 EP claimed
US-7432102-B2 Transformants producing substance pf1022 derivatives, methods for producing the same, and novel biosynthesis genes MEIJI SEIKA KAISHA, LTD. (JP) 2008-10-07 US claimed
EP-1291417-B1 NOVEL (R)-2-HYDROXY-3-PHENYLPROPIONATE (D-PHENYLLACTATE) DEHYDROGENASE AND GENE ENCODING THE SAME MEIJI SEIKA KAISHA (JP) 2007-02-21 EP claimed
CN-1254536-C Novel(R)-2-hydroxy-3-phenylpropionate (D-phenyllactate) dehydrogenase and gene encoding the same MEIJI SEIKA KAISHA (JP) 2006-05-03 CN claimed
EP-1490483-A2 IN VIVO INCORPORATION OF UNNATURAL AMINO ACIDS The Scripps Research Institute (US) 2004-12-29 EP claimed
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 claimed
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 claimed
US-20030082575-A1 Translation system for use in the generation of protein containing adjusted amino acid sequences THE SCRIPPS RESEARCH INSTITUTE (US) 2003-05-01 US claimed
WO-2002085923-A2 IN VIVO INCORPORATION OF UNNATURAL AMINO ACIDS THE SCRIPPS RESEARCH INSTITUTE (US) 2002-10-31 WO claimed
EP-1223215-A1 TRANSFORMANT PRODUCING SECONDARY METABOLITE MODIFIED WITH FUNCTIONAL GROUP AND NOVEL BIOSYNTHESIS GENES MEIJI SEIKA KAISHA LTD. (JP) 2002-07-17 EP claimed

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 2690/4885MAPT 3877/4885MAPK1 2857/4885

“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.