SCHEMBL3544403

SCHEMBL3544403

Cc1ccccc1Sc1cc(F)ccc1C1CCNCC1

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 5/20 0.51
SLC6A2 P23975 8/20 0.48
SLC6A4 P31645 8/20 0.48
SLC6A3 Q01959 7/20 0.48
HTR1A P08908 7/20 0.48
HTR6 P50406 5/20 0.46
HTR3A P46098 2/20 0.44

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
SCHEMBL3543522 0.91 HTR2C (0.55) HTR2CSLC6A2SLC6A4SLC6A3HTR1A
Trifluoroacetic Acid SCHEMBL5742975 0.90 HTR2C (0.42) HTR2CSLC6A2SLC6A4SLC6A3HTR1A
SCHEMBL3547741 0.90 HTR2C (0.51) HTR2CSLC6A2SLC6A4SLC6A3HTR1A
SCHEMBL3544185 0.89 SLC6A2 (0.46) HTR2CSLC6A2SLC6A4SLC6A3HTR1A
SCHEMBL3548484 0.86 HTR6 (0.47) HTR2CSLC6A2SLC6A4SLC6A3HTR1A
SCHEMBL2469257 0.84 HTR2C (0.67) HTR2CSLC6A2SLC6A4SLC6A3HTR1A
SCHEMBL3546054 0.84 SLC6A2 (0.48) SLC6A2SLC6A4SLC6A3HTR1AHTR6
SCHEMBL3549082 0.82 HTR2C (0.54) HTR2CSLC6A2SLC6A4SLC6A3HTR1A
SCHEMBL3541188 0.82 SLC6A2 (0.48) HTR2CSLC6A2SLC6A4SLC6A3HTR1A
SCHEMBL3542378 0.81 HTR1A (0.44) HTR2CSLC6A2SLC6A4SLC6A3HTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060100242-A1 such as 4-[2-(4-Chloro-phenylsulfanyl)-5-trifluoromethyl-phenyl]-piperidine, used as antidepressants and anxiolytic agents; treatment of panic and obsessive compulsive disorders H.LUNDBECK A/S (DK) 2006-05-11 US claimed
US-7732463-B2 4-(2-phenylsulfanyl-phenyl)-piperidine derivatives as serotonin reuptake inhibitors H. LUNDBECK A/S (DK) 2010-06-08 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 (1 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-20060100242-A1 such as 4-[2-(4-Chloro-phenylsulfanyl)-5-trifluoromethyl-phenyl]-piperidine, used as antidepressants and anxiolytic agents; treatment of panic and obsessive compulsive disorders HTR4, HTR5A, TPH1 HTR2C 4/4885SLC6A2 84/4885SLC6A4 14/4885

“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.