SCHEMBL402733

SCHEMBL402733

CCOC(=O)CC(=O)c1nccn1C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGAM O43451 1/20 0.42
GAA P10253 1/20 0.42
SI P14410 1/20 0.42
MGAM2 Q2M2H8 1/20 0.42
ALDH1A1 P00352 3/20 0.40
MAPT P10636 2/20 0.40
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
RGS12 O14924 1/20 0.40
NAMPT P43490 1/20 0.40
TBXAS1 P24557 2/20 0.39
PKM P14618 1/20 0.38
RAB9A P51151 2/20 0.37
NPC1 O15118 1/20 0.37
LMNA P02545 3/20 0.37
LPO P22079 2/20 0.37
CYP1A2 P05177 1/20 0.37
HPGD P15428 1/20 0.37
HSD17B10 Q99714 1/20 0.37

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
SCHEMBL18366656 0.86 TNF (0.40) ALDH1A1MAPTRGS12TBXAS1FPR2
SCHEMBL509681 0.85 NAMPT (0.42) GAAALDH1A1MAPTMEN1KMT2A
SCHEMBL25254399 0.85 ALDH1A1 (0.39) GAAALDH1A1MAPTKMT2ARGS12
SCHEMBL403466 0.80 PKM (0.40) MGAMGAASIMGAM2ALDH1A1
SCHEMBL1822302 0.80 ALDH1A1 (0.46) ALDH1A1MAPTKDM4EKMT2ARGS12
SCHEMBL18787644 0.80 NAMPT (0.39) GAAALDH1A1MAPTKDM4EKMT2A
SCHEMBL12094827 0.78 NAMPT (0.43) GAAALDH1A1MAPTMEN1KMT2A
SCHEMBL368253 0.78 LPO (0.39) ALDH1A1MAPTKDM4ERGS12NAMPT
SCHEMBL15979655 0.76 NAMPT (0.44) GAAALDH1A1MAPTMEN1KMT2A
SCHEMBL404151 0.75 ALDH1A1 (0.43) MGAMGAASIMGAM2ALDH1A1

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 17 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12545668-B2 Cyclic amine derivative as agent for promoting advillin function, and novel cyclic amine derivative and pharmaceutical use thereof TORAY INDUSTRIES, INC. (JP) 2026-02-10 US disclosed
US-20220081431-A1 CYCLIC AMINE DERIVATIVE AS AGENT FOR PROMOTING ADVILLIN FUNCTION, AND NOVEL CYCLIC AMINE DERIVATIVE AND PHARMACEUTICAL USE THEREOF TORAY INDUSTRIES, INC. (JP) 2022-03-17 US disclosed
EP-3903784-A1 CYCLIC AMINE DERIVATIVE AS ADVILLIN FUNCTION PROMOTER AND NOVEL CYCLIC AMINE DERIVATIVE AND PHARMACEUTICAL USE THEREOF Toray Industries, Inc. (JP) 2021-11-03 EP disclosed
CN-113194947-A Cyclic amine derivatives as Advillin function promoters and novel cyclic amine derivatives and pharmaceutical use thereof 东丽株式会社 2021-07-30 CN disclosed
WO-2020138281-A1 CYCLIC AMINE DERIVATIVE AS ADVILLIN FUNCTION PROMOTER AND NOVEL CYCLIC AMINE DERIVATIVE AND PHARMACEUTICAL USE THEREOF 東レ株式会社 2020-07-02 WO disclosed
EP-3263565-B1 CYCLIC AMINE DERIVATIVE AND PHARMACEUTICAL USE THEREOF TORAY INDUSTRIES (JP) 2019-06-26 EP disclosed
US-10173999-B2 Cyclic amine derivative and pharmaceutical use thereof TORAY INDUSTRIES, INC. (JP) 2019-01-08 US disclosed
US-10173999-B2 Cyclic amine derivative and pharmaceutical use thereof TORAY INDUSTRIES, INC. (JP) 2019-01-08 US disclosed
US-20180065950-A1 CYCLIC AMINE DERIVATIVE AND PHARMACEUTICAL USE THEREOF TORAY INDUSTRIES, INC. (JP) 2018-03-08 US disclosed
US-20180065950-A1 CYCLIC AMINE DERIVATIVE AND PHARMACEUTICAL USE THEREOF TORAY INDUSTRIES, INC. (JP) 2018-03-08 US disclosed
US-20180065950-A1 CYCLIC AMINE DERIVATIVE AND PHARMACEUTICAL USE THEREOF TORAY INDUSTRIES, INC. (JP) 2018-03-08 US disclosed
EP-3263565-A1 CYCLIC AMINE DERIVATIVE AND PHARMACEUTICAL USE THEREOF Toray Industries, Inc. (JP) 2018-01-03 EP disclosed
WO-2016136944-A1 CYCLIC AMINE DERIVATIVE AND PHARMACEUTICAL USE THEREOF 東レ株式会社 2016-09-01 WO disclosed
US-20120022107-A1 2-(PIPERIDIN-1-YL)-4-AZOLYL-THIAZOLE-5-CARBOXYLIC ACID DERIVATIVES AGAINST BACTERIAL INFECTIONS ASTRAZENECA AB (SE) 2012-01-26 US disclosed
US-20120022107-A1 2-(PIPERIDIN-1-YL)-4-AZOLYL-THIAZOLE-5-CARBOXYLIC ACID DERIVATIVES AGAINST BACTERIAL INFECTIONS ASTRAZENECA AB (SE) 2012-01-26 US disclosed
US-20120022107-A1 2-(PIPERIDIN-1-YL)-4-AZOLYL-THIAZOLE-5-CARBOXYLIC ACID DERIVATIVES AGAINST BACTERIAL INFECTIONS ASTRAZENECA AB (SE) 2012-01-26 US disclosed
WO-2010067125-A1 2- (PIPERIDIN-1-YL) -4-AZOLYL-THIAZOLE-5-CARBOXYLIC ACID DERIVATIVES AGAINST BACTERIAL INFECTIONS ASTRAZENECA AB (SE) 2010-06-17 WO 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 (5 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-12545668-B2 Cyclic amine derivative as agent for promoting advillin function, and novel cyclic amine derivative and pharmaceutical use thereof SSB, TLR9, C5AR2 MGAM 2206/4885GAA 2447/4885SI 4079/4885
US-10173999-B2 Cyclic amine derivative and pharmaceutical use thereof OPRL1, PDE3A, TRPV1 MGAM 4526/4885GAA 3188/4885SI 4134/4885
US-20120022107-A1 2-(PIPERIDIN-1-YL)-4-AZOLYL-THIAZOLE-5-CARBOXYLIC ACID DERIVATIVES AGAINST BACTERIAL INFECTIONS PIR, TLR5, ALPI MGAM 1118/4885GAA 603/4885SI 87/4885
US-20180065950-A1 CYCLIC AMINE DERIVATIVE AND PHARMACEUTICAL USE THEREOF OPRL1, PDE3A, TRPV1 MGAM 4526/4885GAA 3188/4885SI 4134/4885
US-20220081431-A1 CYCLIC AMINE DERIVATIVE AS AGENT FOR PROMOTING ADVILLIN FUNCTION, AND NOVEL CYCLIC AMINE DERIVATIVE AND PHARMACEUTICAL USE THEREOF ADCY10, ADCK5, AANAT MGAM 4378/4885GAA 3206/4885SI 3090/4885

“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.