SCHEMBL4186691

SCHEMBL4186691

Clc1ccc(OCC2CCCCC2)cc1

nearest known ligand 0.61

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PARP15 Q460N3 4/20 0.58
PARP10 Q53GL7 4/20 0.58
LTA4H P09960 4/20 0.54
PARP2 Q9UGN5 1/20 0.51
GRM2 Q14416 2/20 0.50
HPGD P15428 1/20 0.49
SLC6A4 P31645 1/20 0.49
HTR6 P50406 1/20 0.49

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
SCHEMBL3667235 0.90 PARP15 (0.55) PARP15PARP10LTA4HPARP2
SCHEMBL3251238 0.81 TDP1 (0.68) LTA4HSLC6A4
SCHEMBL30674540 0.81 NFE2L2 (0.70) GRM2HPGD
SCHEMBL21579077 0.81 PARP10 (0.58) PARP15PARP10PARP2GRM2HPGD
SCHEMBL81903 0.81 PARP15 (0.58) PARP15PARP10PARP2GRM2HPGD
SCHEMBL2657957 0.81 NFE2L2 (0.69) PARP15PARP10PARP2GRM2HPGD
SCHEMBL3726896 0.81 PARP10 (0.63) PARP15PARP10PARP2GRM2HPGD
SCHEMBL21579020 0.81 PARP10 (0.58) PARP15PARP10PARP2GRM2HPGD
SCHEMBL21578972 0.81 PARP10 (0.63) PARP15PARP10PARP2GRM2HPGD
SCHEMBL385757 0.81 PARP10 (0.58) PARP15PARP10PARP2GRM2HPGD

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-20090181939-A1 Azetidinecarboxamide Derivatives And Their Use In The Treatment Of CB1 Receptor Mediated Disorders VERNALIS RESEARCH LIMITED. (GB) 2009-07-16 US disclosed
US-20070173486-A1 Azetidinecarboxamide derivatives and their use in the treatment of cb1 receptor mediated disordrs VERNALIS RESEARCH LIMITED (GB) 2007-07-26 US disclosed
EP-1618105-A1 AZETIDINECARBOXAMIDE DERIVATIVES AND THEIR USE IN THE TREATMENT OF CB1 RECEPTOR MEDIATED DISORDERS VERNALIS RESEARCH LIMITED (GB) 2006-01-25 EP disclosed
WO-2004096794-A1 AZETIDINECARBOXAMIDE DERIVATIVES AND THEIR USE IN THE TREATMENT OF CB1 RECEPTOR MEDIATED DISORDRS VERNALIS RESEARCH LIMITED (GB) 2004-11-11 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 (2 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-20090181939-A1 Azetidinecarboxamide Derivatives And Their Use In The Treatment Of CB1 Receptor Mediated Disorders CNR1, CNR2, GPR119 PARP15 3282/4885PARP10 3012/4885LTA4H 4127/4885
US-20070173486-A1 Azetidinecarboxamide derivatives and their use in the treatment of cb1 receptor mediated disordrs CNR1, CNR2, GPR119 PARP15 3506/4885PARP10 3453/4885LTA4H 4348/4885

“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.