SCHEMBL101125

SCHEMBL101125

Nc1ccc(C(=O)O)c(F)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.61
KDM4E B2RXH2 6/20 0.61
MAPT P10636 4/20 0.61
CYP3A4 P08684 2/20 0.61
GAA P10253 1/20 0.61
ESR2 Q92731 1/20 0.61
PTPN1 P18031 1/20 0.61
TDP1 Q9NUW8 4/20 0.55
KMT2A Q03164 3/20 0.55
MEN1 O00255 2/20 0.55
THRB P10828 2/20 0.55
RECQL P46063 2/20 0.55
HPGD P15428 2/20 0.55
HSD17B10 Q99714 2/20 0.55
POLB P06746 2/20 0.55
MCL1 Q07820 2/20 0.55
USP2 O75604 1/20 0.55
PKM P14618 1/20 0.55
APEX1 P27695 1/20 0.55
BLM P54132 1/20 0.55

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
SCHEMBL26972103 1.00 ALDH1A1 (0.61) ALDH1A1KDM4EMAPTCYP3A4GAA
SCHEMBL30708577 1.00 ALDH1A1 (0.61) ALDH1A1KDM4EMAPTCYP3A4GAA
Methylamine SCHEMBL28523185 0.96 KDM4E (0.57) ALDH1A1KDM4EMAPTCYP3A4GAA
Carbamic Acid SCHEMBL9949365 0.96 ALDH1A1 (0.57) ALDH1A1KDM4EMAPTCYP3A4GAA
Aminobenzoic Acid SCHEMBL19952814 0.91 KDM4E (0.52) ALDH1A1KDM4EMAPTCYP3A4GAA
Deanol SCHEMBL8614733 0.85 ALDH1A1 (0.46) ALDH1A1KDM4EMAPTCYP3A4GAA
SCHEMBL25298918 0.83 ALDH1A1 (0.52) ALDH1A1KDM4EMAPTCYP3A4GAA
SCHEMBL113659 0.83 DGAT1 (0.62) ALDH1A1KDM4EMAPTCYP3A4GAA
SCHEMBL416879 0.83 KDM4E (0.61) ALDH1A1KDM4EMAPTCYP3A4GAA
SCHEMBL30925630 0.83 KDM4E (0.61) ALDH1A1KDM4EMAPTCYP3A4GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12344571-B1 Organic color center-tailored, semiconducting carbon nanotubes and their method of manufacture UNIVERSITY OF MARYLAND, COLLEGE PARK (US) 2025-07-01 US claimed
WO-2025085689-A1 EXTRACELLULAR SMALL MOLECULE ACTIVATORS TARGETING BESTROPHIN CHANNELS FOR DISEASE TREATMENT THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2025-04-24 WO claimed
CN-116082246-B Synthesis method of ethylene thiourea derivative 长沙泽达医药科技有限公司 2023-11-21 CN claimed
US-20230226228-A1 POSITRON IMAGING TOMOGRAPHY IMAGING AGENT COMPOSITION AND METHOD FOR DETECTION OF BACTERIAL INFECTION THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) 2023-07-20 US claimed
CN-116082246-A Synthesis method of ethylene thiourea derivative 长沙泽达医药科技有限公司 2023-05-09 CN claimed
CN-115505579-A P-aminobenzoic acid hydroxylase and application thereof 中国科学院青岛生物能源与过程研究所 2022-12-23 CN claimed
WO-2021226076-A1 POSITRON IMAGING TOMOGRAPHY IMAGING AGENT COMPOSITION AND METHOD FOR DETECTION OF BACTERIAL INFECTION THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) 2021-11-11 WO claimed
WO-2018048882-A9 POSITRON IMAGING TOMOGRAPHY IMAGING AGENT COMPOSITION AND METHOD FOR BACTERIAL INFECTION THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) 2019-01-10 WO claimed
CN-108947782-A A kind of bromine fluorine Multi substituted benzenes formaldehyde derivatives and preparation method 上海罕道医药科技有限公司 2018-12-07 CN claimed
WO-2018048882-A1 POSITRON IMAGING TOMOGRAPHY IMAGING AGENT COMPOSITION AND METHOD FOR BACTERIAL INFECTION THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) 2018-03-15 WO claimed
CN-106800536-A A kind of preparation method of the miscellaneous Shandong amine of grace 南京慧博生物科技有限公司 2017-06-06 CN claimed
CN-105753673-A Improved synthesizing method of 1,5-diketone compound 辛旭峰 2016-07-13 CN claimed
CN-105367512-A Synthesizing method of medicine intermediate benzothiazole compound ZHAO LINA 2016-03-02 CN claimed
CN-103980135-B A kind of preparation method of 4-amino-2-fluorobenzoic acid ZHEJIANG LANGHUA PHARMACEUTICAL CO., LTD. (CN) 2015-10-28 CN claimed
CN-103980135-A Preparation method of 4-amino-2-fluorobenzoic acid ZHEJIANG LANGHUA PHARMACEUTICAL CO LTD 2014-08-13 CN claimed
CN-103923765-A Detergent Composition For Process Of Manufacturing Semiconductors And Displays COWON INNOTECH INC 2014-07-16 CN claimed
CN-101768265-A Modified nylon and preparation method thereof UNIV SUZHOU 2010-07-07 CN claimed
EP-1244613-A2 METHODS FOR PRODUCING CYANOBENZOIC ACID DERIVATIVES MILLENIUM PHARMACEUTICALS, INC. (US) 2002-10-02 EP claimed
US-20020072626-A1 Methods for producing 3-cyano- and 4-cyano-benzoic acid derivative compounds COR THERAPEUTICS, INC. 2002-06-13 US claimed
WO-2001042198-A2 METHODS FOR PRODUCING CYANOBENZOIC ACID DERIVATIVES MILLENIUM PHARMACEUTICALS, INC. (US) 2001-06-14 WO 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 (3 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-20020072626-A1 Methods for producing 3-cyano- and 4-cyano-benzoic acid derivative compounds PFKP, PCCA, TBXAS1 ALDH1A1 931/4885KDM4E 2444/4885MAPT 4627/4885
US-20230226228-A1 POSITRON IMAGING TOMOGRAPHY IMAGING AGENT COMPOSITION AND METHOD FOR DETECTION OF BACTERIAL INFECTION TLR5, SLC10A2, FNTB ALDH1A1 3223/4885KDM4E 3329/4885MAPT 778/4885
US-12344571-B1 Organic color center-tailored, semiconducting carbon nanotubes and their method of manufacture NOS1, NOS3, NOS2 ALDH1A1 754/4885KDM4E 4548/4885MAPT 799/4885

“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.