SCHEMBL6202610

SCHEMBL6202610

c1cc2c(c3c1CCC3)CCNCC2

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 11/20 0.57
HTR2A P28223 10/20 0.57
HTR2B P41595 10/20 0.57
PNMT P11086 4/20 0.44
ADRA2A P08913 1/20 0.44
ADRA2B P18089 1/20 0.44
ADRA2C P18825 1/20 0.44
PARP1 P09874 1/20 0.41
DRD2 P14416 1/20 0.40
DRD1 P21728 1/20 0.40
DRD4 P21917 1/20 0.40
DRD5 P21918 1/20 0.40
DRD3 P35462 1/20 0.40
ADCY6 O43306 1/20 0.39
ADCY3 O60266 1/20 0.39
ADCY9 O60503 1/20 0.39
ADCY5 O95622 1/20 0.39
ADCY8 P40145 1/20 0.39
ADCY7 P51828 1/20 0.39
ADCY2 Q08462 1/20 0.39

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
SCHEMBL23944932 0.82 PARP1 (0.46) PNMTPARP1
SCHEMBL1278375 0.76 BCL2L1 (0.52) PARP1
SCHEMBL15502922 0.76 HTR2C (0.50) HTR2CHTR2AHTR2BPNMTADRA2A
SCHEMBL4507795 0.76 NOTUM (0.47) HTR2CHTR2AHTR2BPNMTPARP1
SCHEMBL9461283 0.73 BCL2L1 (0.50) PARP1
SCHEMBL2534784 0.73 PNMT (0.55) HTR2CHTR2AHTR2BPNMTADRA2A
SCHEMBL12579957 0.73 HTR2C (0.62) HTR2CHTR2AHTR2BPNMTADRA2A
SCHEMBL10199923 0.73 HTR2C (0.62) HTR2CHTR2AHTR2BPNMTADRA2A
SCHEMBL15821044 0.72 HTR2C (0.44) HTR2CHTR2AHTR2BPNMTADRA2A
SCHEMBL15819018 0.71 HTR2C (0.47) HTR2CHTR2AHTR2BPNMTADRA2A

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 19 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2938345-A2 BENZAZEPINES AS SEROTONIN 5-HT2C RECEPTOR LIGANDS AND USES THEREOF ABT Holding Company (US) 2015-11-04 EP claimed
US-20140275035-A1 THIENYLINDOLE AZEPINES AS SEROTONIN 5-HT2C RECEPTOR LIGANDS AND USES THEREOF ABT HOLDING COMPANY (US) 2014-09-18 US claimed
US-20140194411-A1 BENZAZEPINES AS SEROTONIN 5-HT2C RECEPTOR LIGANDS AND USES THEREOF ABT HOLDING COMPANY (US) 2014-07-10 US claimed
WO-2014100815-A2 BENZAZEPINES AS SEROTONIN 5-HT2C RECEPTOR LIGANDS AND USES THEREOF ABT HOLDING COMPANY (US) 2014-06-26 WO claimed
EP-2938345-B1 BENZAZEPINES AS SEROTONIN 5-HT2C RECEPTOR LIGANDS AND USES THEREOF ABT HOLDING CO (US) 2018-08-22 EP disclosed
US-9309262-B2 Thienylindole azepines as serotonin 5-HT2C receptor ligands and uses thereof ABT HOLDING COMPANY (US) 2016-04-12 US disclosed
US-9284277-B2 Benzazepines as serotonin 5-HT2C receptor ligands and uses thereof ABT HOLDING COMPANY (US) 2016-03-15 US disclosed
US-9284277-B2 Benzazepines as serotonin 5-HT2C receptor ligands and uses thereof ABT HOLDING COMPANY (US) 2016-03-15 US disclosed
EP-2938345-A2 BENZAZEPINES AS SEROTONIN 5-HT2C RECEPTOR LIGANDS AND USES THEREOF ABT Holding Company (US) 2015-11-04 EP disclosed
WO-2014159067-A1 THIENYLINDOLE AZEPINES AS SEROTONIN 5-HT2C RECEPTOR LIGANDS AND USES THEREOF ABT HOLDING COMPANY (US) 2014-10-02 WO disclosed
US-20140275035-A1 THIENYLINDOLE AZEPINES AS SEROTONIN 5-HT2C RECEPTOR LIGANDS AND USES THEREOF ABT HOLDING COMPANY (US) 2014-09-18 US disclosed
US-20140194411-A1 BENZAZEPINES AS SEROTONIN 5-HT2C RECEPTOR LIGANDS AND USES THEREOF ABT HOLDING COMPANY (US) 2014-07-10 US disclosed
US-20140194411-A1 BENZAZEPINES AS SEROTONIN 5-HT2C RECEPTOR LIGANDS AND USES THEREOF ABT HOLDING COMPANY (US) 2014-07-10 US disclosed
US-20140194411-A1 BENZAZEPINES AS SEROTONIN 5-HT2C RECEPTOR LIGANDS AND USES THEREOF ABT HOLDING COMPANY (US) 2014-07-10 US disclosed
WO-2014100815-A2 BENZAZEPINES AS SEROTONIN 5-HT2C RECEPTOR LIGANDS AND USES THEREOF ABT HOLDING COMPANY (US) 2014-06-26 WO disclosed
WO-2014100815-A2 BENZAZEPINES AS SEROTONIN 5-HT2C RECEPTOR LIGANDS AND USES THEREOF ABT HOLDING COMPANY (US) 2014-06-26 WO disclosed
EP-1343796-A4 COMPOUNDS AND METHODS SMITHKLINE BEECHAM CORP (US) 2005-01-12 EP disclosed
EP-1343796-A2 COMPOUNDS AND METHODS SmithKline Beecham Corporation (US) 2003-09-17 EP disclosed
WO-2002034760-A2 COMPOUNDS AND METHODS SMITHKLINE BEECHAM CORPORATION (US) 2002-05-02 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 (2 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-20140275035-A1 THIENYLINDOLE AZEPINES AS SEROTONIN 5-HT2C RECEPTOR LIGANDS AND USES THEREOF HTR2C, HTR2A, HTR5A HTR2C 1/4885HTR2A 2/4885HTR2B 11/4885
US-20140194411-A1 BENZAZEPINES AS SEROTONIN 5-HT2C RECEPTOR LIGANDS AND USES THEREOF HTR2C, HTR2A, HTR5A HTR2C 1/4885HTR2A 2/4885HTR2B 4/4885

“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.