SCHEMBL1144081

SCHEMBL1144081

Cc1cccc(C2CCNCC2)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 10/20 1.00
SLC18A3 Q16572 1/20 0.59
SIGMAR1 Q99720 1/20 0.59
QDPR P09417 1/20 0.50
HTR6 P50406 1/20 0.47
SOS1 Q07889 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
GABRA1 P14867 1/20 0.46
GABRB2 P47870 1/20 0.46
TLR9 Q9NR96 1/20 0.46
TLR8 Q9NR97 1/20 0.46
TLR7 Q9NYK1 1/20 0.46

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
SCHEMBL29559035 1.00 HTR2C (1.00) HTR2CSLC18A3SIGMAR1QDPRHTR6
Hydrochloric Acid SCHEMBL2802413 0.98 HTR2C (1.00) HTR2CSLC18A3SIGMAR1QDPRHTR6
SCHEMBL12058643 0.89 HTR2C (0.80) HTR2C
Hydrochloric Acid SCHEMBL9311565 0.87 HTR2C (0.81) HTR2C
SCHEMBL1515269 0.86 HTR2C (0.74) HTR2CMEN1KMT2A
Toluene SCHEMBL27818685 0.82 SLC18A3 (0.80) HTR2CSLC18A3SIGMAR1HTR6KMT2A
SCHEMBL2538410 0.82 HTR2C (0.69) HTR2CMEN1KMT2A
SCHEMBL3069922 0.82 HTR2C (0.69) HTR2CMEN1KMT2A
SCHEMBL2145468 0.80 HTR2C (0.67) HTR2C
SCHEMBL3062414 0.80 HTR2C (0.67) HTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4731223-A1 MORPHOLINE AND 1,4-OXAZEPANE COMPOUNDS AND ITS USE IN THERAPY Universitat De Barcelona (ES) 2026-04-29 EP disclosed
US-12479816-B2 20-HETE formation inhibitors University of Pittsburgh—of the Commonwealth System of Higher Education (US) 2025-11-25 US disclosed
CN-115362151-B Arylpiperidines as monoacylglycerol lipase modulators 詹森药业有限公司 2025-02-11 CN disclosed
WO-2024261340-A1 MORPHOLINE AND 1,4-OXAZEPANE COMPOUNDS AND ITS USE IN THERAPY UNIVERSITAT DE BARCELONA (ES) 2024-12-26 WO disclosed
CN-118834313-A Zwitterionic polymer, ion exchange membrane, and preparation methods and applications thereof 佛山绿动氢能科技有限公司 2024-10-25 CN disclosed
CN-117720721-B Anion exchange polymer, ion exchange membrane, and preparation methods and application thereof 国家电投集团氢能科技发展有限公司 2024-04-30 CN disclosed
US-20240092781-A1 ARYL PIPERIDINES AS MONOACYLGLYCEROL LIPASE MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2024-03-21 US disclosed
CN-117720721-A Anion exchange polymer, ion exchange membrane, and preparation methods and application thereof 国家电投集团氢能科技发展有限公司 2024-03-19 CN disclosed
CN-117487047-A Phosphonic acid functionalized polymer, multifunctional styrene polymer and application thereof 国家电投集团氢能科技发展有限公司 2024-02-02 CN disclosed
EP-4289838-A2 ARYLMETHOXY ISOINDOLINE DERIVATIVES AND COMPOSITIONS COMPRISING AND METHODS OF USING THE SAME Celgene Corporation (US) 2023-12-13 EP disclosed
US-20020193602-A1 Novel opiate compounds, methods of making and methods of use RESEARCH TRIANGLE INSTITUTE (US) 2002-12-19 US disclosed
US-20020111358-A1 Phenoxypropylamine compounds MITSUBISHI PHARMA CORPORATION (JP) 2002-08-15 US disclosed
EP-1188747-A1 PHENOXYPROPYLAMINE COMPOUNDS Mitsubishi Pharma Corporation (JP) 2002-03-20 EP disclosed
EP-0126480-B1 SUBSTITUTED ISOQUINOLINE DERIVATIVES, METHOD FOR THEIR PREPARATION, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THESE COMPOUNDS F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1988-01-20 EP disclosed
US-4559403-A FOR TREATMENT OF CEREBRAL AND CARDIAC ISCHEMIAS HOFFMANN-LA ROCHE INC. (US) 1985-12-17 US disclosed
US-4544657-A ANTISCHEMIC AGENTS HOFFMANN-LA ROCHE INC. (US) 1985-10-01 US disclosed
EP-0126480-A1 Substituted isoquinoline derivatives, method for their preparation, and pharmaceutical compositions containing these compounds F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) 1984-11-28 EP disclosed
US-4077958-A ANTIDEPRESSANTS E. R. SQUIBB & SONS, INC. (US) 1978-03-07 US disclosed
US-4007191-A ANTIDEPRESSANT E. R. SQUIBB & SONS, INC. (US) 1977-02-08 US disclosed
US-3935227-A ANTIDEPRESSANTS, ANTIANXIETY, ANTIINFLAMMATORY AGENTS E. R. SQUIBB & SONS, INC. (US) 1976-01-27 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 (4 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-20240092781-A1 ARYL PIPERIDINES AS MONOACYLGLYCEROL LIPASE MODULATORS MGLL, LPL, PNLIP HTR2C 64/4885SLC18A3 593/4885SIGMAR1 147/4885
US-20020193602-A1 Novel opiate compounds, methods of making and methods of use OPRK1, OPRM1, OPRL1 HTR2C 94/4885SLC18A3 26/4885SIGMAR1 6/4885
US-12479816-B2 20-HETE formation inhibitors CYP4A22, ALOX5, ALOX15 HTR2C 235/4885SLC18A3 919/4885SIGMAR1 2679/4885
US-20020111358-A1 Phenoxypropylamine compounds HTR1A, HTR1D, HTR5A HTR2C 9/4885SLC18A3 162/4885SIGMAR1 50/4885

“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.