SCHEMBL7793337

SCHEMBL7793337

Cc1ccc(N(C)C2CCCCC2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.44
TSHR P16473 1/20 0.44
POLB P06746 2/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
TRPM8 Q7Z2W7 1/20 0.42
CNR1 P21554 2/20 0.40
CNR2 P34972 2/20 0.40
TRPV1 Q8NER1 1/20 0.39
S1PR1 P21453 1/20 0.39
HRH4 Q9H3N8 1/20 0.39
HRH3 Q9Y5N1 1/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
LRRK2 Q5S007 1/20 0.39
GAA P10253 2/20 0.38
HTT P42858 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
KDM4E B2RXH2 1/20 0.38

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
SCHEMBL4485887 0.91 HRH4 (0.44) ALDH1A1TRPV1HRH4HRH3MEN1
SCHEMBL22542050 0.83 ALDH1A1 (0.44) ALDH1A1TSHRPOLBCNR1CNR2
SCHEMBL4168246 0.82 MEN1 (0.43) ALDH1A1TRPV1HRH4HRH3MEN1
SCHEMBL6872363 0.82 TYR (0.44) ALDH1A1TRPV1S1PR1HRH4HRH3
SCHEMBL6608762 0.82 ALDH1A1 (0.46) ALDH1A1TSHRTRPV1HRH4HRH3
SCHEMBL15013072 0.82 TRPA1 (0.49) ALDH1A1TRPV1HRH4HRH3GAA
SCHEMBL516360 0.81 MEN1 (0.49) ALDH1A1TSHRPOLBNPC1RAB9A
SCHEMBL20733110 0.81 ALDH1A1 (0.50) ALDH1A1TSHRNPC1RAB9ATRPM8
SCHEMBL19227318 0.81 ALDH1A1 (0.50) ALDH1A1TSHRNPC1RAB9ATRPM8
SCHEMBL20733138 0.81 ALDH1A1 (0.50) ALDH1A1TSHRNPC1RAB9ATRPM8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119350180-A Industrial preparation method and application of high-purity alpha-aminonitrile 哈尔滨理工大学 2025-01-24 CN claimed
EP-0676429-B1 Composition for urethane-based plastic lens MITSUI CHEMICALS INC (JP) 2000-12-27 EP claimed
CN-119350180-A Industrial preparation method and application of high-purity alpha-aminonitrile 哈尔滨理工大学 2025-01-24 CN disclosed
CN-105189132-B Thermosensitive recording medium exhibiting gold metallic tone and/or thermosensitive recording medium exhibiting two different tones 王子控股株式会社 2018-06-26 CN disclosed
CN-101679596-B Super-high refractive index optical resin composition having high heat deflection temperature and excellent thermal stability, optical lens using same and method for manufacturing the optical lens KOC SOLUTION CO LTD 2013-02-20 CN disclosed
US-8258129-B2 4-heterocycloalkylpyri(mi)dines, process for the preparation thereof and their use as medicaments BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-09-04 US disclosed
CN-101679596-A Super-high refractive index optical resin composition having high heat deflection temperature and excellent thermal stability, optical lens using same and method for manufacturing the optical lens SHIN DAE SPECIALTIES CO LTD 2010-03-24 CN disclosed
US-20090203673-A1 4-HETEROCYCLOALKYLPYRI(MI)DINES, PROCESS FOR THE PREPARATION THEREOF AND THEIR USE AS MEDICAMENTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-08-13 US disclosed
EP-1150963-A1 SUBSTITUTED 4-AMINO-2-ARYLTETRAHYDROQUINAZOLINES, THEIR PREPARATION, THEIR USE AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM Aventis Pharma Deutschland GmbH (DE) 2001-11-07 EP disclosed
EP-0676429-B1 Composition for urethane-based plastic lens MITSUI CHEMICALS INC (JP) 2000-12-27 EP disclosed
WO-2000046214-A1 SUBSTITUTED 4-AMINO-2-ARYLTETRAHYDROQUINAZOLINES, THEIR PREPARATION, THEIR USE AND PHARMACEUTICAL COMPOSITIONS COMPRISING THEM AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2000-08-10 WO disclosed
US-5693738-A REACTING AN ISOCYANATE AND/OR AN ISOTHIOCYANATE COMPOUND WITH A HYDROXYL AND/OR MERCAPTO-CONTAINING COMPOUND IN THE PRESENCE OF A COMPLEX OF A TERTIARY AMINE AND A LEWIS ACID MITSUI TOATSU CHEMICALS, INC. (JP) 1997-12-02 US disclosed
EP-0676429-A2 Composition for urethane-base plastic lens MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1995-10-11 EP 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-20090203673-A1 4-HETEROCYCLOALKYLPYRI(MI)DINES, PROCESS FOR THE PREPARATION THEREOF AND THEIR USE AS MEDICAMENTS CCNI, MKI67, CCNA1 ALDH1A1 293/4885TSHR 1848/4885POLB 1683/4885

“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.