SCHEMBL2693873

SCHEMBL2693873

CC(Cl)[CH]CCc1ccc(Cl)cc1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ TAAR1 Q96RJ0 2/20 0.44
▸ SLC6A2 P23975 1/20 0.44
▸ SLC6A3 Q01959 1/20 0.44
▸ AOC3 Q16853 1/20 0.41
▸ KCNH2 Q12809 3/20 0.40
▸ GAA P10253 1/20 0.39
▸ MAOB P27338 1/20 0.38
▸ IDO1 P14902 3/20 0.38
▸ SLC6A4 P31645 1/20 0.38
▸ BCL2L1 Q07817 1/20 0.37
▸ TMEM97 Q5BJF2 1/20 0.36

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
SCHEMBL28055725 0.86 TAAR1 (0.45) TAAR1SLC6A2SLC6A3AOC3KCNH2
SCHEMBL432651 0.74 TAAR1 (0.50) TAAR1SLC6A2SLC6A3AOC3KCNH2
SCHEMBL8471773 0.72 TAAR1 (0.52) TAAR1AOC3KCNH2MAOBIDO1
SCHEMBL9112609 0.71 KCNH2 (0.49) TAAR1SLC6A2SLC6A3AOC3KCNH2
SCHEMBL9150371 0.71 TAAR1 (0.47) TAAR1SLC6A2SLC6A3AOC3KCNH2
SCHEMBL4902643 0.70 TAAR1 (0.50) TAAR1AOC3KCNH2MAOBIDO1
SCHEMBL896217 0.70 TAAR1 (0.50) TAAR1AOC3KCNH2MAOBIDO1
SCHEMBL27912646 0.70 TAAR1 (0.56) TAAR1SLC6A2SLC6A3AOC3KCNH2
SCHEMBL436099 0.70 AOC3 (0.52) TAAR1SLC6A2SLC6A3AOC3KCNH2
SCHEMBL2135113 0.69 TAAR1 (0.68) TAAR1AOC3MAOBIDO1SLC6A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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-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

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-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 TAAR1 203/4885SLC6A2 136/4885SLC6A3 59/4885
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 TAAR1 203/4885SLC6A2 136/4885SLC6A3 59/4885

“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.

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