SCHEMBL187618

SCHEMBL187618

c1ccc2c(c1)CCNO2

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 1/20 0.46
MAOB P27338 2/20 0.41
PNMT P11086 1/20 0.41
CD44 P16070 1/20 0.41
MAOA P21397 1/20 0.39
OXTR P30559 1/20 0.38
PDPK1 O15530 1/20 0.36
PARP1 P09874 1/20 0.36
PARP10 Q53GL7 1/20 0.36
PARP11 Q9NR21 1/20 0.36
GAA P10253 2/20 0.35
NPSR1 Q6W5P4 1/20 0.35
TSHR P16473 1/20 0.35
PRCP P42785 3/20 0.34
ABCG2 Q9UNQ0 1/20 0.33
ITGB2 P05107 1/20 0.33
ICAM1 P05362 1/20 0.33
ITGAL P20701 1/20 0.33

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
SCHEMBL29687441 1.00 HTR2C (0.46) HTR2CMAOBPNMTCD44MAOA
SCHEMBL7034209 1.00 HTR2C (0.46) HTR2CMAOBPNMTCD44MAOA
Methylamine SCHEMBL2638183 0.94 HTR2C (0.41) HTR2CMAOBPNMTCD44MAOA
Piperidine SCHEMBL5729886 0.90 HTR2C (0.48) HTR2CMAOBPNMTCD44MAOA
SCHEMBL2379149 0.89 HTR2C (0.38) HTR2CMAOBPNMTCD44MAOA
Cyclopropane SCHEMBL29171080 0.87 TSHR (0.42) HTR2CMAOBPNMTCD44MAOA
SCHEMBL451710 0.87 TSHR (0.42) HTR2CMAOBPNMTCD44MAOA
SCHEMBL30601152 0.87 TSHR (0.42) HTR2CMAOBPNMTCD44MAOA
SCHEMBL4583944 0.86 MMP3 (0.41) HTR2C
SCHEMBL19956062 0.84 PDPK1 (0.44) HTR2CMAOBPNMTCD44MAOA

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

Appears in 2808 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4118091-B1 IMMUNOMODULATING UREA AZALIDES ZOETIS SERVICES LLC (US) 2025-06-18 EP claimed
US-20250171447-A1 ADENOSINE RECEPTOR ANTAGONISTS, PHARMACEUTICAL COMPOSITIONS AND THEIR USE THEREOF MERCK SHARP & DOHME LLC (US) 2025-05-29 US claimed
EP-4479056-A1 ADENOSINE RECEPTOR ANTAGONISTS, PHARMACEUTICAL COMPOSITIONS AND THEIR USE THEREOF Merck Sharp & Dohme LLC (US) 2024-12-25 EP claimed
CN-112543764-B Amide compound with BET proteolytic induction effect and medical application thereof 田边三菱制药株式会社 2024-05-10 CN claimed
EP-4313302-A1 INHIBITORS OF NLRP3 INFLAMMASOME Bioage Labs, Inc. (US) 2024-02-07 EP claimed
US-11878020-B2 Modulators of Rho-associated protein kinase REDX PHARMA PLC (GB) 2024-01-23 US claimed
CN-117157278-A Inhibitors of NLRP3 inflammasome 柏奥艾奇实验室公司 2023-12-01 CN claimed
WO-2023158626-A1 ADENOSINE RECEPTOR ANTAGONISTS, PHARMACEUTICAL COMPOSITIONS AND THEIR USE THEREOF MERCK SHARP & DOHME LLC (US) 2023-08-24 WO claimed
EP-3421454-B9 PIPERIDINE DERIVATIVE OTSUKA PHARMA CO LTD (JP) 2023-08-09 EP claimed
EP-3421454-B1 PIPERIDINE DERIVATIVE OTSUKA PHARMA CO LTD (JP) 2023-04-05 EP claimed
EP-0147382-B1 PROCESS FOR DEPOSITION OF RESIN DISPERSIONS ON METAL SUBSTRATES Monsanto Company (US) 1988-05-11 EP claimed
EP-0119896-B1 5-AMINO-1,2-DITHIOL-3-ONE DERIVATIVES, THEIR PREPARATION AND MEDICINAL COMPOSITIONS CONTAINING THEM RHONE-POULENC SANTE (FR) 1986-10-08 EP claimed
US-4557979-A ELECTROPHORESIS OF A NEUTRALIZED BLEND OF A POLY-1,3-BENZOXAZINE AND REACTIVE POLYAMINE; PROTECTIVE COATINGS MONSANTO COMPANY (US) 1985-12-10 US claimed
EP-0149989-A2 Aqueous dispersions of polyamines and poly (dihydrobenzoxazines) Monsanto Company (US) 1985-07-31 EP claimed
EP-0149987-A2 Polymerizable compositions comprising polyamines and poly (dihydrobenzoxazines) Monsanto Company (US) 1985-07-31 EP claimed
EP-0147382-A2 Process for deposition of resin dispersions on metal substrates Monsanto Company (US) 1985-07-03 EP claimed
EP-0081125-B1 CATIONIC DYES, THEIR PREPARATION PROCESS AND THEIR USE IN DYEING AND MASS DYEING BAYER AG (DE) 1985-05-08 EP claimed
US-4507428-A CATIONIC RESINS FOR PRIMERS AND PROTECTIVE COATINGS MONSANTO COMPANY (US) 1985-03-26 US claimed
US-4501864-A PROTECTIVE COATINGS; RAPID CURING BY HEATING; POT LIFE MONSANTO COMPANY (US) 1985-02-26 US claimed
EP-0081125-A1 Cationic dyes, their preparation process and their use in dyeing and mass dyeing BAYER AG (DE) 1983-06-15 EP claimed