SCHEMBL373923

SCHEMBL373923

c1ccc2c(C3CCNCC3)c[nH]c2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 5/20 1.00
ADRB2 P07550 1/20 1.00
APP P05067 1/20 0.58
SLC6A4 P31645 2/20 0.57
KDM4E B2RXH2 2/20 0.56
ATM Q13315 1/20 0.56
BRD4 O60885 1/20 0.56
ALDH1A1 P00352 1/20 0.56
POLB P06746 1/20 0.56
CREBBP Q92793 1/20 0.56
ADRA1D P25100 3/20 0.54
HTR2A P28223 3/20 0.53
HTR2B P41595 3/20 0.53
HTR3E A5X5Y0 1/20 0.53
HTR3B O95264 1/20 0.53
HTR3A P46098 1/20 0.53
HTR3D Q70Z44 1/20 0.53
HTR3C Q8WXA8 1/20 0.53

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
SCHEMBL29502102 1.00 HTR2C (1.00) HTR2CADRB2APPSLC6A4KDM4E
Hydrochloric Acid SCHEMBL31285949 0.98 HTR2C (1.00) HTR2CADRB2APPSLC6A4KDM4E
Hydrochloric Acid SCHEMBL893070 0.98 HTR2C (1.00) HTR2CADRB2APPSLC6A4KDM4E
Methane SCHEMBL10788775 0.98 HTR2C (0.97) HTR2CADRB2APPSLC6A4KDM4E
SCHEMBL1445576 0.90 HTR2C (0.81) HTR2CADRB2APPSLC6A4KDM4E
SCHEMBL30279603 0.90 HTR2C (0.81) HTR2CADRB2APPSLC6A4KDM4E
SCHEMBL734917 0.89 HTR2C (0.79) HTR2CADRB2SLC6A4KDM4EATM
SCHEMBL807343 0.85 HTR2C (0.74) HTR2CADRB2KDM4EATMBRD4
SCHEMBL28594057 0.85 HTR2C (0.74) HTR2CADRB2KDM4EATMBRD4
Tert-Butyl Formate SCHEMBL28799577 0.84 HTR2C (0.70) HTR2CADRB2APPSLC6A4KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100048513-A1 Novel inhibitors of chymase HAWKINS MICHAEL J 2010-02-25 US claimed
US-7459444-B2 Inhibitors of chymase JANSSEN PHARMACEUTICA N.V. (BE) 2008-12-02 US claimed
US-20050176769-A1 Novel inhibitors of chymase JANSSEN PHARMACEUTICA, N.V. (BE) 2005-08-11 US claimed
EP-0070053-B1 NOVEL BICYCLIC PYRIMIDIN-5-ONE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 1986-04-16 EP claimed
EP-0177087-A2 1H-Indol-3-yl containing 1,3-dimethyl-1H-purine-2,6-diones JANSSEN PHARMACEUTICA N.V. (BE) 1986-04-09 EP claimed
EP-0058975-B1 SUBSTITUTED N-(4-INDOLYL-PIPERIDINO-ALKYL) BENZIMIDAZOLONES, PROCESSES FOR THEIR PREPARATION AND THEIR USE AS PHARMACEUTICAL PREPARATIONS Boehringer Ingelheim Pharmaceuticals Inc. (US) 1984-12-12 EP claimed
EP-0070053-A2 Novel bicyclic pyrimidin-5-one derivatives JANSSEN PHARMACEUTICA N.V. (BE) 1983-01-19 EP claimed
EP-0058975-A1 Substituted N-(4-indolyl-piperidino-alkyl) benzimidazolones, processes for their preparation and their use as pharmaceutical preparations Boehringer Ingelheim Pharmaceuticals Inc. (US) 1982-09-01 EP claimed
US-3993764-A 3-(4*-PIPERIDYL)-INDOLES ROUSSEL-UCLAF (FR) 1976-11-23 US claimed
JP-6073011-A None JP disclosed
US-20250034106-A1 3-CYCLOAMINO-INDOLE COMPOUNDS AS SEROTONERGIC AGENTS USEFUL FOR THE TREATMENT OF DISORDERS RELATED THERETO MINDSET PHARMA INC. (CA) 2025-01-30 US disclosed
US-20240383850-A1 INDOLE DERIVATIVES AS SEROTONERGIC AGENTS USEFUL FOR THE TREATMENT OF DISORDERS RELATED THERETO MINDSET PHARMA INC. (CA) 2024-11-21 US disclosed
US-20240376052-A1 N-SUBSTITUTED INDOLE DERIVATIVES AS SEROTONERGIC AGENTS USEFUL FOR THE TREATMENT OF DISORDERS RELATED THERETO MINDSET PHARMA INC. (CA) 2024-11-14 US disclosed
US-20240067631-A1 PYRAZOLE DERIVATIVES USEFUL AS NAMPT MODULATORS CYTOKINETICS, INC. 2024-02-29 US disclosed
US-3993764-A 3-(4*-PIPERIDYL)-INDOLES ROUSSEL-UCLAF (FR) 1976-11-23 US disclosed
US-3988453-A Novel phenothiazines as neuroleptics ROUSSEL-UCLAF (FR) 1976-10-26 US disclosed
US-3980658-A SEDATIVES, TRANQUILIZERS BOEHRINGER INGELHEIM GMBH (DT) 1976-09-14 US disclosed
US-3950527-A SEDATIVES ROUSSEL-UCLAF (FR) 1976-04-13 US disclosed
US-3947578-A Omega-[4-(3\"-indolyl)-piperidino]-alkyl-arylketones as nevroleptics ROUSSEL UCLAF (FR) 1976-03-30 US disclosed
JP-H00673011-A 0001-01-01 JP 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 (6 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-20240376052-A1 N-SUBSTITUTED INDOLE DERIVATIVES AS SEROTONERGIC AGENTS USEFUL FOR THE TREATMENT OF DISORDERS RELATED THERETO TPH1, HTR5A, TPH2 HTR2C 8/4885ADRB2 94/4885APP 1276/4885
US-20100048513-A1 Novel inhibitors of chymase CMA1, SERPINB1, TPSAB1 HTR2C 3442/4885ADRB2 2638/4885APP 456/4885
US-20050176769-A1 Novel inhibitors of chymase CMA1, SERPINB1, TPSAB1 HTR2C 3442/4885ADRB2 2638/4885APP 456/4885
US-20240383850-A1 INDOLE DERIVATIVES AS SEROTONERGIC AGENTS USEFUL FOR THE TREATMENT OF DISORDERS RELATED THERETO TPH1, HTR5A, TPH2 HTR2C 8/4885ADRB2 98/4885APP 1269/4885
US-20240067631-A1 PYRAZOLE DERIVATIVES USEFUL AS NAMPT MODULATORS NAMPT, NNT, NAPRT HTR2C 3782/4885ADRB2 1336/4885APP 2845/4885
US-20250034106-A1 3-CYCLOAMINO-INDOLE COMPOUNDS AS SEROTONERGIC AGENTS USEFUL FOR THE TREATMENT OF DISORDERS RELATED THERETO TPH1, HTR3A, HTR1A HTR2C 7/4885ADRB2 114/4885APP 467/4885

“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.