SCHEMBL718078

SCHEMBL718078

Cc1ccc(CCN)cc1C

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 7/20 0.56
CYP1A2 P05177 1/20 0.56
CYP2A6 P11509 1/20 0.56
KDM4E B2RXH2 3/20 0.50
MAPK1 P28482 3/20 0.50
ADRA2A P08913 2/20 0.50
MAPT P10636 2/20 0.50
DRD2 P14416 2/20 0.50
DRD1 P21728 2/20 0.50
DRD4 P21917 2/20 0.50
DRD5 P21918 2/20 0.50
SLC6A2 P23975 2/20 0.50
DRD3 P35462 2/20 0.50
RECQL P46063 2/20 0.50
SLC6A3 Q01959 2/20 0.50
TDP1 Q9NUW8 2/20 0.50
ALDH1A1 P00352 2/20 0.50
PNMT P11086 1/20 0.50
ATM Q13315 1/20 0.50
TP53 P04637 1/20 0.50

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
Hydrochloric Acid SCHEMBL857309 0.98 TAAR1 (0.54) TAAR1CYP1A2CYP2A6KDM4EMAPK1
SCHEMBL5146820 0.86 SKP2 (0.50) TAAR1CYP1A2CYP2A6SLC6A2SLC6A3
SCHEMBL29380988 0.85 PTGS1 (0.45) CYP1A2MAPTSLC6A2SLC6A3ALDH1A1
SCHEMBL29597103 0.85 PTGS1 (0.45) CYP1A2MAPTSLC6A2SLC6A3ALDH1A1
SCHEMBL311370 0.85 PTGS1 (0.45) CYP1A2MAPTSLC6A2SLC6A3ALDH1A1
Hydrochloric Acid SCHEMBL5146884 0.85 SKP2 (0.48) TAAR1CYP1A2CYP2A6KDM4EMAPK1
SCHEMBL8605679 0.85 SKP2 (0.48) SLC6A2SLC6A3
SCHEMBL6480325 0.82 GFER (0.61) TDP1ALDH1A1GFERTSHR
SCHEMBL23903966 0.82 SLC6A2 (0.58) TAAR1CYP1A2CYP2A6KDM4EMAPK1
SCHEMBL4368721 0.82 CASP1 (0.54) TAAR1CYP1A2CYP2A6KDM4EMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2074089-B1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2013-09-18 EP claimed
EP-2228065-B1 Heterocyclo inhibitors of potassium channel function BRISTOL MYERS SQUIBB CO (US) 2012-12-26 EP claimed
US-8222248-B2 Organic compounds NOVARTIS AG (CH) 2012-07-17 US claimed
EP-1451160-B1 PYRAZOLE-AMIDES FOR USE IN THE TREATMENT OF PAIN ICAGEN INC (US) 2010-01-13 EP claimed
US-20260062376-A1 SQUARAMIDE DERIVATIVES AS CB1 ALLOSTERIC MODULATORS RES TRIANGLE INST (US) 2026-03-05 US disclosed
US-20260022283-A1 ADMIXED MODIFIERS FOR ADHESIVES US ARMY RES LAB (US) 2026-01-22 US disclosed
EP-4532463-A1 SQUARAMIDE DERIVATIVES AS CB1 ALLOSTERIC MODULATORS Research Triangle Institute (US) 2025-04-09 EP disclosed
US-20250092020-A1 IDO/TDO Inhibitor GENERAL INCORPORATED ASSOCIATION PHARMA VALLEY PROJECT SUPPORTING ORGANIZATION (JP) 2025-03-20 US disclosed
US-12209079-B2 IDO/TDO inhibitor GENERAL INCORPORATED ASSOCIATION PHARMA VALLEY PROJECT SUPPORTING ORGANIZATION (JP) 2025-01-28 US disclosed
US-20240208992-A1 MACROCYCLES AS CFTR MODULATORS IDORSIA PHARMACEUTICALS LTD (CH) 2024-06-27 US disclosed
US-20240002708-A1 ADMIXED MODIFIERS FOR ADHESIVES THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE ARMY 2024-01-04 US disclosed
WO-2023235548-A1 SQUARAMIDE DERIVATIVES AS CB1 ALLOSTERIC MODULATORS RESEARCH TRIANGLE INSTITUTE (US) 2023-12-07 WO disclosed
US-5242944-A Analgesics or antiinflammatory agents KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1993-09-07 US disclosed
WO-1993017021-A1 HETEROCYCLIC COMPOUNDS FOR ENHANCING ANTITUMOR ACTIVITY PFIZER, INC. (US) 1993-09-02 WO disclosed
US-5231181-A PROCESS FOR THE PREPARATION OF (8AS,12AS,13AS)-DECAHYDROISOQUINO ((2,1-G) (1,6)-NAPHTHYRIDIN-8-ONE DERIVATIVES SYNTEX (U.S.A.) INC. (US) 1993-07-27 US disclosed
EP-0525360-A2 Novel phenylacetamide derivatives and processes for the preparation thereof KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 1993-02-03 EP disclosed
EP-0505183-A2 Process for the preparation of (8aS,12aS,13aS)-decahydroisoquino[2,1-g][1,6]-naphthyridin-8-one derivatives SYNTEX (U.S.A.) INC. (US) 1992-09-23 EP disclosed
US-4191765-A 1-Aryloxy-2-hydroxy-3-aminopropanes HOECHST AKTIENGESELLSCHAFT (DE) 1980-03-04 US disclosed
US-4158063-A Acylamino(alkyl)benzene derivatives and process for preparing them HOECHST AKTIENGESELLSCHAFT (DE) 1979-06-12 US disclosed
US-4107165-A ANTICOAGULANTS ENDO LABORATORIES (US) 1978-08-15 US 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-12209079-B2 IDO/TDO inhibitor IDO1, IDO2, TDO2 TAAR1 582/4885CYP1A2 363/4885CYP2A6 1301/4885
US-20260062376-A1 SQUARAMIDE DERIVATIVES AS CB1 ALLOSTERIC MODULATORS CNR1, CNR2, OPRL1 TAAR1 159/4885CYP1A2 2407/4885CYP2A6 217/4885
US-20260022283-A1 ADMIXED MODIFIERS FOR ADHESIVES UBE3A, DDT, UBE4A TAAR1 976/4885CYP1A2 2577/4885CYP2A6 1465/4885
US-20240208992-A1 MACROCYCLES AS CFTR MODULATORS CFTR, PKD1, ARRB1 TAAR1 1932/4885CYP1A2 862/4885CYP2A6 1659/4885
US-20250092020-A1 IDO/TDO Inhibitor IDO1, IDO2, TDO2 TAAR1 582/4885CYP1A2 363/4885CYP2A6 1301/4885

“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.