SCHEMBL1114261

SCHEMBL1114261

NC1(C(=O)O)CCc2[nH]c3ccccc3c2C1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.45
MAPT P10636 1/20 0.45
BAZ2B Q9UIF8 1/20 0.45
HTR2A P28223 1/20 0.44
HTR2C P28335 1/20 0.44
NR2E1 Q9Y466 2/20 0.43
KDM4E B2RXH2 2/20 0.43
HTR5A P47898 1/20 0.43
NISCH Q9Y2I1 1/20 0.43
TAAR1 Q96RJ0 1/20 0.42
ALDH1A1 P00352 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
SIRT1 Q96EB6 1/20 0.41
FAAH O00519 1/20 0.41
TRPV1 Q8NER1 1/20 0.41
CHRNA7 P36544 1/20 0.40

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
SCHEMBL6526481 1.00 LMNA (0.45) LMNAMAPTBAZ2BHTR2AHTR2C
SCHEMBL11838605 0.83 LMNA (0.47) LMNAMAPTBAZ2BHTR2AHTR2C
SCHEMBL4969326 0.81 MAPT (0.43) LMNAMAPTBAZ2BHTR2AHTR2C
SCHEMBL11204300 0.80 HTR2A (0.47) LMNAMAPTBAZ2BHTR2AHTR2C
SCHEMBL5881040 0.79 BAZ2B (0.53) LMNABAZ2BSIRT1
SCHEMBL5881078 0.79 MAPKAPK2 (0.52) LMNAMAPTKDM4EALDH1A1
SCHEMBL31684725 0.77 HTR2A (0.46) HTR2AHTR2CNR2E1KDM4EHTR5A
SCHEMBL6529663 0.77 HTR2A (0.49) LMNAMAPTBAZ2BHTR2AHTR2C
SCHEMBL4651124 0.76 HTR2A (0.45) LMNAMAPTBAZ2BHTR2AHTR2C
SCHEMBL4652083 0.76 HTR2A (0.45) LMNAMAPTBAZ2BHTR2AHTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100500654-C Tetrahydrocarbazole derivatives as ligands for G-protein coupled receptors (GPCRs) ZENTARIS AG (DE) 2009-06-17 CN claimed
US-7122570-B2 Tetrahydrocarbazol derivatives as ligands for G-protein-coupled receptors (GPCR) ZENTARIS AG (DE) 2006-10-17 US claimed
WO-2005047247-A1 NOVEL1,3-DISUBSTITUTED AZETIDINE DERIVATIVES FOR USE AS 5HT2A RECEPTOR LIGANDS MERCK SHARP & DOHME LIMITED (GB) 2005-05-26 WO claimed
CN-1599720-A Tetrahydrocarbazole derivatives as ligands for G-protein coupled receptors (GPCRs) ZENTARIS AG (DE) 2005-03-23 CN claimed
US-20030232873-A1 Tetrahydrocarbazol derivatives as ligands for G-protein-coupled receptors (GPCR) ZENTARIS AG (DE) 2003-12-18 US claimed
US-8541462-B2 Tetrahydrocarbazole derivatives as ligands of G-protein coupled receptors AETERNA ZENTARIS GMBH (DE) 2013-09-24 US disclosed
US-20120122763-A1 NOVEL TETRAHYDROCARBAZOLE DERIVATIVES AS LIGANDS OF G-PROTEIN COUPLED RECEPTORS AETERNA ZENTARIS GMBH (DE) 2012-05-17 US disclosed
US-8148546-B2 Tetrahydrocarbazole derivatives as ligands of G-protein coupled receptors AETERNA ZENTARIS GMBH (DE) 2012-04-03 US disclosed
US-8088890-B2 Peptides and peptidomimetic compounds, the manufacturing thereof as well as their use for preparing a therapeutically and/or preventively active pharmaceutical composition FIBREX MEDICAL RESEARCH & DEVELOPMENT GMBH (AT) 2012-01-03 US disclosed
US-8088890-B2 Peptides and peptidomimetic compounds, the manufacturing thereof as well as their use for preparing a therapeutically and/or preventively active pharmaceutical composition FIBREX MEDICAL RESEARCH & DEVELOPMENT GMBH (AT) 2012-01-03 US disclosed
US-8067456-B2 Tetrahydrocarbazole derivatives having improved biological action and improved solubility as ligands of G-protein coupled receptors (GPCPs) AETERNA ZENTARIS GMBH (DE) 2011-11-29 US disclosed
WO-2011060018-A2 COMPOSITIONS AND METHODS FOR USING PEPTIDES, MODIFIED PEPTIDES, PEPTIDOMIMETICS AND FIBRIN DERIVATIVES IKARIA DEVELOPMENT SUBSIDIARY TWO LLC (US) 2011-05-19 WO disclosed
US-7122570-B2 Tetrahydrocarbazol derivatives as ligands for G-protein-coupled receptors (GPCR) ZENTARIS AG (DE) 2006-10-17 US disclosed
WO-2006005484-A1 NOVEL TETRAHYDROCARBAZOLE DERIVATIVES WITH IMPROVED BIOLOGICAL ACTION AND IMPROVED SOLUBILITY AS LIGANDS FOR G-PROTEIN COUPLED RECEPTORS (GPCRS) ZENTARIS GMBH (DE) 2006-01-19 WO disclosed
US-20060014818-A1 Novel tetrahydrocarbazole derivatives having improved biological action and improved solubility as ligands of G-protein coupled receptors (GPCRs) MUSC FOUNDATION FOR RESEARCH DEVELOPMENT 2006-01-19 US disclosed
WO-2005033099-A2 NOVEL DIPEPTIDYL PEPTIDASE IV INHIBITORS; PROCESSES FOR THEIR PREPARATION AND COMPOSITIONS THEREOF GLENMARK PHARMACEUTICALS LTD. (US) 2005-04-14 WO disclosed
CN-1599720-A Tetrahydrocarbazole derivatives as ligands for G-protein coupled receptors (GPCRs) ZENTARIS AG (DE) 2005-03-23 CN disclosed
EP-1453803-A2 TETRAHYDROCARBOZOLE DERIVATIVES AS LIGANDS FOR G-PROTEIN COUPLED RECEPTORS (GPCR) Zentaris GmbH (DE) 2004-09-08 EP disclosed
US-20030232873-A1 Tetrahydrocarbazol derivatives as ligands for G-protein-coupled receptors (GPCR) ZENTARIS AG (DE) 2003-12-18 US disclosed
WO-2003051837-A2 TETRAHYDROCARBOZOLE DERIVATIVES AS LIGANDS FOR G-PROTEIN COUPLED RECEPTORS (GPCR) ZENTARIS GMBH (DE) 2003-06-26 WO 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 (3 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-20120122763-A1 NOVEL TETRAHYDROCARBAZOLE DERIVATIVES AS LIGANDS OF G-PROTEIN COUPLED RECEPTORS GPR88, GPR34, GPR27 LMNA 3715/4885MAPT 3996/4885BAZ2B 1232/4885
US-20030232873-A1 Tetrahydrocarbazol derivatives as ligands for G-protein-coupled receptors (GPCR) GPR4, GPR88, GPR35 LMNA 4253/4885MAPT 2593/4885BAZ2B 1032/4885
US-20060014818-A1 Novel tetrahydrocarbazole derivatives having improved biological action and improved solubility as ligands of G-protein coupled receptors (GPCRs) GPR88, GPR34, GPR35 LMNA 3646/4885MAPT 3394/4885BAZ2B 1821/4885

“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.