SCHEMBL2695344

SCHEMBL2695344

CC1(N)CNCCc2ccc(Cl)cc21

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 10/20 0.71
HTR2C P28335 9/20 0.71
HTR2B P41595 8/20 0.51
PNMT P11086 1/20 0.49
ADRB1 P08588 1/20 0.46
HTR1A P08908 1/20 0.46
ADRA2A P08913 1/20 0.46
ADRA2B P18089 1/20 0.46
ADRA2C P18825 1/20 0.46
CNR1 P21554 1/20 0.46
SLC6A2 P23975 1/20 0.46
SLC6A4 P31645 1/20 0.46
HRH1 P35367 1/20 0.46
KCNH2 Q12809 1/20 0.46
KDM1A O60341 2/20 0.41
F7 P08709 1/20 0.38
PARP1 P09874 1/20 0.38
F3 P13726 1/20 0.38
PARP10 Q53GL7 1/20 0.38
ALOX12 P18054 2/20 0.37

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
SCHEMBL6298572 0.85 HTR2A (0.73) HTR2AHTR2CHTR2BPNMTADRB1
Water SCHEMBL16701244 0.84 HTR2A (0.71) HTR2AHTR2CHTR2BPNMTADRB1
SCHEMBL2368756 0.83 HTR2A (1.00) HTR2AHTR2CHTR2BPNMTADRB1
SCHEMBL3757689 0.81 HTR2A (0.71) HTR2AHTR2CHTR2BPNMTADRB1
Hydrochloric Acid SCHEMBL27967632 0.79 HTR2A (0.69) HTR2AHTR2CHTR2BPNMTADRB1
SCHEMBL173414 0.75 HTR2A (0.58) HTR2AHTR2CHTR2BPNMTADRB1
SCHEMBL1907938 0.74 HTR2A (0.62) HTR2AHTR2CHTR2BPNMTADRB1
SCHEMBL170990 0.73 HTR2C (0.59) HTR2AHTR2CHTR2BPNMTADRB1
SCHEMBL2477900 0.72 HTR2A (0.58) HTR2AHTR2CHTR2BPNMTADRB1
SCHEMBL173952 0.71 HTR2A (0.57) HTR2AHTR2CHTR2BPNMTADRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150038701-A1 PROCESSES FOR THE PREPARATION OF 8-CHLORO-1-METHYL-2,3,4,5-TETRAHYDRO-1H-3-BENZAZEPINE AND INTERMEDIATES RELATED THERETO ARENA PHARMACEUTICALS, INC. 2015-02-05 US disclosed
US-8802845-B2 Processes for the preparation of 8-chloro-1-methyl-2,3,4,5-tetrahydro-1H-3-benzazepine and intermediates related thereto Arena Phamaceuticals, Inc. (US) 2014-08-12 US disclosed
US-8501935-B2 Processes for the preparation of 8-chloro-1-methyl-2,3,4,5-tetrahydro-1H-3-benzazepine and intermediates related thereto ARENA PHARMACEUTICALS, INC. (US) 2013-08-06 US disclosed
US-20130178619-A1 PROCESSES FOR THE PREPARATION OF 8-CHLORO-1-METHYL-2,3,4,5-TETRAHYDRO-1H-3-BENZAZEPINE AND INTERMEDIATES RELATED THERETO ARENA PHARMACEUTICALS, INC. 2013-07-11 US disclosed
US-20120283431-A1 PROCESSES FOR THE PREPARATION OF 8-CHLORO-1-METHYL-2,3,4,5-TETRAHYDRO-1H-3-BENZAZEPINE AND INTERMEDIATES RELATED THERETO ARENA PHARMACEUTICALS, INC. 2012-11-08 US disclosed
EP-2518053-A1 PROCESS FOR THE PREPARATION OF 8-CHLORO-1-METHYL-2,3,4,5-TETRAHYDRO-1H-3-BENZAZEPINE Arena Pharmaceuticals, Inc. (US) 2012-10-31 EP disclosed
EP-2471779-A1 Process for the resolution of a mixture of (R)- and (S)-8-chloro-1-methyl-2,3,4,5-tetrahydro-1H-3-benzazepine Arena Pharmaceuticals, Inc. (US) 2012-07-04 EP disclosed
US-8168782-B2 synthesis of lorcaserin ARENA PHARMACEUTICALS, INC. (US) 2012-05-01 US disclosed
US-20090143576-A1 Processes for the Preparation of 8-Chloro-1-Methyl-2,3,4,5-Tetrahydro-1H-3-Benzazepine and Intermediates Related Thereto ARENA PHARMACEUTICALS, INC. 2009-06-04 US disclosed
EP-2001852-A2 PROCESSES FOR THE PREPARATION OF 8-CHLORO-1-METHYL-2,3,4,5-TETRAHYDRO-1H-3-BENZAZEPINE AND INTERMEDIATES RELATED THERETO Arena Pharmaceuticals, Inc. (US) 2008-12-17 EP disclosed
WO-2007120517-A2 PROCESSES FOR THE PREPARATION OF 8-CHLORO-1-METHYL-2,3,4,5-TETRAHYDRO-1H-3-BENZAZEPINE AND INTERMEDIATES RELATED THERETO ARENA PHARMACEUTICALS, INC. (US) 2007-10-25 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 (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-20130178619-A1 PROCESSES FOR THE PREPARATION OF 8-CHLORO-1-METHYL-2,3,4,5-TETRAHYDRO-1H-3-BENZAZEPINE AND INTERMEDIATES RELATED THERETO HTR2C, HTR3C, HTR1A HTR2A 12/4885HTR2C 1/4885HTR2B 17/4885
US-20150038701-A1 PROCESSES FOR THE PREPARATION OF 8-CHLORO-1-METHYL-2,3,4,5-TETRAHYDRO-1H-3-BENZAZEPINE AND INTERMEDIATES RELATED THERETO HTR2C, HTR3C, HTR1A HTR2A 12/4885HTR2C 1/4885HTR2B 17/4885
US-20090143576-A1 Processes for the Preparation of 8-Chloro-1-Methyl-2,3,4,5-Tetrahydro-1H-3-Benzazepine and Intermediates Related Thereto HTR2C, HTR3C, HTR1A HTR2A 12/4885HTR2C 1/4885HTR2B 17/4885
US-20120283431-A1 PROCESSES FOR THE PREPARATION OF 8-CHLORO-1-METHYL-2,3,4,5-TETRAHYDRO-1H-3-BENZAZEPINE AND INTERMEDIATES RELATED THERETO HTR2C, HTR3C, HTR1A HTR2A 12/4885HTR2C 1/4885HTR2B 17/4885

“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.