SCHEMBL15030385

SCHEMBL15030385

CCCC1CCNC(CO)C1

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 1/20 0.36
DRD3 P35462 1/20 0.35
SLC6A3 Q01959 1/20 0.35
ARG1 P05089 1/20 0.33
AGL P35573 1/20 0.32
GNAI3 P08754 1/20 0.32
GNAO1 P09471 1/20 0.32
GNAI1 P63096 1/20 0.32
DPP4 P27487 1/20 0.31
GBA2 Q9HCG7 1/20 0.31

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
SCHEMBL25893834 0.86 CHRNA7 (0.36) CHRNA7DRD3SLC6A3ARG1
SCHEMBL16508763 0.84 AGL (0.34) AGLGNAI3GNAO1GNAI1GBA2
SCHEMBL17476073 0.81 AGL (0.38) ARG1AGLGBA2
SCHEMBL17476075 0.81 AGL (0.38) ARG1AGLGBA2
SCHEMBL17476076 0.81 AGL (0.38) ARG1AGLGBA2
SCHEMBL4378367 0.81 CHRNA7 (0.33) CHRNA7DRD3SLC6A3ARG1
SCHEMBL24745613 0.81 ARG1 (0.33) ARG1AGLGBA2
SCHEMBL14493190 0.80 DPP4 (0.38) ARG1DPP4GBA2
SCHEMBL26791035 0.80 DPP4 (0.38) ARG1DPP4GBA2
SCHEMBL15533712 0.76 GLB1 (0.31)

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
EP-2809156-B1 ALLOSTERIC MODULATORS OF 5-HYDROXYTRYPTAMINE 2C RECEPTOR (5-HT2CR) UNIV TEXAS (US) 2017-05-24 EP disclosed
US-9533973-B2 Allosteric modulators of 5-hydroxytryptamine 2C receptor (5-HT2CR) THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2017-01-03 US disclosed
US-20140336375-A1 ALLOSTERIC MODULATORS OF 5-HYDROXYTRYPTAMINE 2C RECEPTOR (5-HT2CR) THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2014-11-13 US disclosed
WO-2013086266-A2 ALLOSTERIC MODULATORS OF 5-HYDROXYTRYPTAMINE 2C RECEPTOR (5-HT2CR) THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2013-06-13 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-20140336375-A1 ALLOSTERIC MODULATORS OF 5-HYDROXYTRYPTAMINE 2C RECEPTOR (5-HT2CR) HTR2C, HTR2A, HTR3B CHRNA7 134/4885DRD3 151/4885SLC6A3 170/4885

“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.