SCHEMBL2114185

SCHEMBL2114185

Clc1ccc(O[C@H]2C[C@H]3CNC[C@H]3C2)cc1

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 7/20 0.59
SLC6A2 P23975 3/20 0.59
SLC6A3 Q01959 3/20 0.59
HTR2C P28335 2/20 0.40
HTR2B P41595 1/20 0.40
KCNH2 Q12809 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
SCHEMBL2114187 1.00 SLC6A4 (0.59) SLC6A4SLC6A2SLC6A3HTR2CHTR2B
SCHEMBL232806 0.84 SLC6A4 (0.63) SLC6A4SLC6A2SLC6A3HTR2CHTR2B
Hydrochloric Acid SCHEMBL5222288 0.82 SLC6A4 (0.61) SLC6A4SLC6A2SLC6A3HTR2CHTR2B
SCHEMBL903939 0.81 SLC6A4 (0.40) SLC6A4SLC6A2SLC6A3HTR2CHTR2B
SCHEMBL17643108 0.81 GRIN1 (0.44) SLC6A4SLC6A2SLC6A3
SCHEMBL17643355 0.81 GRIN1 (0.44) SLC6A4SLC6A2SLC6A3
SCHEMBL2114839 0.81 GRIN1 (0.44) SLC6A4SLC6A2SLC6A3
SCHEMBL2114840 0.81 GRIN1 (0.44) SLC6A4SLC6A2SLC6A3
SCHEMBL24136460 0.81 SLC6A4 (0.56) SLC6A4SLC6A2SLC6A3
SCHEMBL20086419 0.81 SLC6A4 (0.56) SLC6A4SLC6A2SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2430006-B1 CYCLOPENTA[C]PYRROLE-2-CARBOXYLATE DERIVATIVES, PREPARATION THEREOF, AND THERAPEUTIC USE THEREOF SANOFI SA (FR) 2014-11-26 EP disclosed
US-8697883-B2 Cyclopenta[C]pyrrole-2-carboxylate derivatives, preparation thereof and therapeutic use thereof SANOFI (FR) 2014-04-15 US disclosed
US-20120095040-A1 CYCLOPENTA[C]PYRROLE-2-CARBOXYLATE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF SANOFI (FR) 2012-04-19 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-20120095040-A1 CYCLOPENTA[C]PYRROLE-2-CARBOXYLATE DERIVATIVES, PREPARATION THEREOF AND THERAPEUTIC USE THEREOF EPOR, ACAD9, CBR1 SLC6A4 3490/4885SLC6A2 1817/4885SLC6A3 1435/4885

“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.