SCHEMBL531817

SCHEMBL531817

Cc1ccc2c(c1)CCCN2

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.54
KDM4E B2RXH2 2/20 0.54
GAA P10253 3/20 0.54
ALDH1A1 P00352 2/20 0.54
HSD17B10 Q99714 2/20 0.54
TDP1 Q9NUW8 2/20 0.54
LMNA P02545 1/20 0.54
TP53 P04637 1/20 0.54
THRB P10828 1/20 0.54
ALOX15 P16050 1/20 0.54
CASP1 P29466 1/20 0.54
HTT P42858 1/20 0.54
CASP7 P55210 1/20 0.54
CA12 O43570 1/20 0.53
CA1 P00915 1/20 0.53
CA2 P00918 1/20 0.53
CA9 Q16790 1/20 0.53
DRD2 P14416 1/20 0.46
DRD4 P21917 1/20 0.46
PARP10 Q53GL7 2/20 0.44

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
SCHEMBL4868930 0.94 MAPT (0.49) MAPTKDM4EGAAALDH1A1HSD17B10
SCHEMBL21707873 0.92 MAPT (0.47) MAPTKDM4EGAAALDH1A1HSD17B10
SCHEMBL12461 0.88 DRD2 (0.59) MAPTKDM4EGAAALDH1A1HSD17B10
SCHEMBL3111834 0.84 MAPT (0.50) MAPTKDM4EGAAALDH1A1HSD17B10
SCHEMBL30634161 0.84 MAPT (0.50) MAPTKDM4EGAAALDH1A1HSD17B10
SCHEMBL18770167 0.81 MAPT (0.43) MAPTKDM4EGAAALDH1A1HSD17B10
SCHEMBL115559 0.81 KDM4E (0.46) MAPTKDM4EGAAALDH1A1HSD17B10
Quinoline SCHEMBL28174132 0.81 ALDH1A1 (0.49) MAPTKDM4EGAAALDH1A1HSD17B10
SCHEMBL5467021 0.78 MAPT (0.49) MAPTKDM4EGAAALDH1A1HSD17B10
SCHEMBL20647077 0.77 MAPT (0.50) MAPTKDM4EGAAALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119931978-A Application of monoamine oxidase as catalyst in preparation of quinoline nitrogen heterocyclic compound 河北工业大学 2025-05-06 CN claimed
CN-117229275-B Novel 2-acetamido thiazole compound and preparation method and application thereof 北京中医药大学 2024-06-18 CN claimed
CN-115595096-B Anaerobic adhesive and preparation method thereof 迪马新材料科技(苏州)有限公司 2024-03-12 CN claimed
CN-115160962-B Anaerobic sealant and preparation method thereof 硕德半导体技术(苏州)有限公司 2024-01-26 CN claimed
CN-116376858-A Application of monoamine oxidase from microorganism as catalyst in preparation of quinoline or quinoline derivative 浙江大学杭州国际科创中心 2023-07-04 CN claimed
US-20230093639-A1 PERFUME SYSTEM FOR PERFUMED CONSUMER PRODUCT FIRMENICH SA (CH) 2023-03-23 US claimed
EP-4084769-A1 PERFUME SYSTEM FOR PERFUMED CONSUMER PRODUCT Firmenich SA (CH) 2022-11-09 EP claimed
WO-2021214205-A1 PERFUME SYSTEM FOR PERFUMED CONSUMER PRODUCT FIRMENICH SA (CH) 2021-10-28 WO claimed
CN-109529907-B Nitrogen-doped carbon material supported cobalt catalyst, preparation method thereof and application thereof in catalytic oxidation of N-heterocyclic compound 中南民族大学 2021-10-15 CN claimed
CN-107445891-B Method for catalyzing carbon-hydrogen bond alkylation reaction of aromatic amine 苏州大学 2020-04-10 CN claimed
CN-1500477-A Quick result aerosol with plant aroma and its preparation 丛繁滋 2004-06-02 CN claimed
CN-1475204-A Medicinal Composition, dry powder vapor, nebula, nebula auxiliary preparation for use through mouth and nose and its preparation method 丛繁滋 2004-02-18 CN claimed
US-20030191307-A1 2,4-Diaminopyrimidine compounds useful as immunosuppressants BLUMENKOPF TODD A (US) 2003-10-09 US claimed
US-6369248-B1 HYDROXY ESTERS FOR PERFUMES GIVAUDAN SA (CH) 2002-04-09 US claimed
EP-0989970-A1 FRAGRANCE PRECURSOR COMPOUNDS GIVAUDAN-ROURE (INTERNATIONAL) S.A. (CH) 2000-04-05 EP claimed
EP-0980863-A1 Oxime carboxylic acid derivatives Givaudan Roure (International) S.A. (CH) 2000-02-23 EP claimed
WO-1998058899-A1 FRAGRANCE PRECURSOR COMPOUNDS GIVAUDAN-ROURE (INTERNATIONAL) S.A. (CH) 1998-12-30 WO claimed
CN-1059937-A The production method of technology of fragrant fur FUR MILL ZHUCHENG CITY (CN) 1992-04-01 CN claimed
US-4460760-A ADHESIVES OKURA KOGYO KABUSHIKI KAISHA (JP) 1984-07-17 US claimed
US-4447563-A Anaerobically curable composition and process for preparation thereof OKURA KOGYO KABUSHIKI KAISHA (JP) 1984-05-08 US 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 (2 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-20030191307-A1 2,4-Diaminopyrimidine compounds useful as immunosuppressants CCR1, AOC1, NOD1 MAPT 4588/4885KDM4E 2949/4885GAA 3686/4885
US-20230093639-A1 PERFUME SYSTEM FOR PERFUMED CONSUMER PRODUCT PORCN, FAAH2, FASN MAPT 2828/4885KDM4E 3235/4885GAA 2375/4885

“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.