SCHEMBL4835331

SCHEMBL4835331

CN[C@@H](C)c1cc(F)cc(Cl)c1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 4/20 0.40
SLC6A4 P31645 4/20 0.40
KCNH2 Q12809 3/20 0.40
GPR139 Q6DWJ6 1/20 0.36
RAPGEF4 Q8WZA2 1/20 0.36
TRPM8 Q7Z2W7 1/20 0.35
SLC6A2 P23975 1/20 0.33
EPAS1 Q99814 1/20 0.33
ALDH1A1 P00352 1/20 0.32
MDM2 Q00987 1/20 0.31
ADRB2 P07550 1/20 0.30
PARP14 Q460N5 1/20 0.30
MET P08581 1/20 0.30

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
SCHEMBL4835323 1.00 HTR2A (0.40) HTR2ASLC6A4KCNH2GPR139RAPGEF4
SCHEMBL17790211 0.85 ALDH1A1 (0.36) HTR2ASLC6A4KCNH2SLC6A2ALDH1A1
SCHEMBL4150839 0.85 TSHR (0.40) HTR2ASLC6A4KCNH2GPR139RAPGEF4
SCHEMBL4827313 0.85 ALDH1A1 (0.36) HTR2ASLC6A4KCNH2SLC6A2ALDH1A1
SCHEMBL4832250 0.85 TSHR (0.40) HTR2ASLC6A4KCNH2GPR139RAPGEF4
SCHEMBL4827316 0.85 ALDH1A1 (0.36) HTR2ASLC6A4KCNH2SLC6A2ALDH1A1
Hydrochloric Acid SCHEMBL5394551 0.83 TSHR (0.38) HTR2ASLC6A4KCNH2GPR139ALDH1A1
SCHEMBL4547915 0.79 TRPM8 (0.38) KCNH2GPR139RAPGEF4TRPM8SLC6A2
SCHEMBL20868259 0.77 RAPGEF4 (0.39) GPR139RAPGEF4TRPM8SLC6A2EPAS1
SCHEMBL30512228 0.77 RAPGEF4 (0.39) GPR139RAPGEF4TRPM8SLC6A2EPAS1

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-7442692-B2 Indanyl-piperazine compounds LES LABORATOIRES SERVIER (FR) 2008-10-28 US disclosed
EP-1707564-B1 Indanyl-piperazine derivatives, process for their preparation and pharmaceutical compositions containing them SERVIER LAB (FR) 2007-09-12 EP disclosed
US-20060223830-A1 Indanyl-piperazine compounds LES LABORATOIRES SERVIER (FR) 2006-10-05 US disclosed
EP-1707564-A2 Indanyl-piperazine derivatives, process for their preparation and pharmaceutical compositions containing them Les Laboratoires Servier (FR) 2006-10-04 EP 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-20060223830-A1 Indanyl-piperazine compounds HTR4, NR4A1, NR4A3 HTR2A 86/4885SLC6A4 27/4885KCNH2 360/4885

“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.