SCHEMBL3548168

SCHEMBL3548168

Fc1ccc(Sc2ccc(F)cc2C2CCNCC2)cc1

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 11/20 0.50
SLC6A4 P31645 11/20 0.50
SLC6A3 Q01959 11/20 0.50
HTR1A P08908 9/20 0.50
MAPK14 Q16539 2/20 0.49
HTR3A P46098 3/20 0.46
MKNK1 Q9BUB5 1/20 0.40
MKNK2 Q9HBH9 1/20 0.40
KCNH2 Q12809 1/20 0.40
HTR6 P50406 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
Oxalic Acid SCHEMBL3543674 0.92 HTR1A (0.44) SLC6A2SLC6A4SLC6A3HTR1AMAPK14
SCHEMBL3546050 0.92 MAPK14 (0.46) SLC6A2SLC6A4SLC6A3HTR1AMAPK14
SCHEMBL3545931 0.92 HTR1A (0.51) SLC6A2SLC6A4SLC6A3HTR1AMAPK14
SCHEMBL3544128 0.91 SLC6A2 (0.48) SLC6A2SLC6A4SLC6A3HTR1AMAPK14
SCHEMBL3548275 0.89 HTR2C (0.49) SLC6A2SLC6A4SLC6A3HTR1AMAPK14
SCHEMBL3542162 0.88 MAPK14 (0.43) SLC6A2SLC6A4SLC6A3HTR1AMAPK14
SCHEMBL3551251 0.88 HTR1A (0.46) SLC6A2SLC6A4SLC6A3HTR1AMAPK14
SCHEMBL3546694 0.88 SLC6A2 (0.47) SLC6A2SLC6A4SLC6A3HTR1AMAPK14
SCHEMBL3547044 0.87 SLC6A2 (0.50) SLC6A2SLC6A4SLC6A3HTR1AMAPK14
SCHEMBL3544545 0.86 SLC6A2 (0.43) SLC6A2SLC6A4SLC6A3HTR1AMAPK14

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-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
EP-1626720-A1 4-(2-PHENYLSULFANYL-PHENYL)-PIPERIDINE DERIVATIVES AS SEROTONIN REUPTAKE INHIBITORS H. Lundbeck A/S (DK) 2006-02-22 EP disclosed
WO-2004087156-A1 4-(2-PHENYLSULFANYL-PHENYL)-PIPERIDINE DERIVATIVES AS SEROTONIN REUPTAKE INHIBITORS H. LUNDBECK A/S (DK) 2004-10-14 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 (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 SLC6A2 84/4885SLC6A4 14/4885SLC6A3 61/4885

“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.