SCHEMBL844095

SCHEMBL844095

COCCCn1cc(C(=O)O)c(=O)cc1C

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 9/20 0.46
TYR P14679 2/20 0.46
ALDH1A1 P00352 2/20 0.44
HTT P42858 1/20 0.41
CNR1 P21554 2/20 0.41
LMNA P02545 1/20 0.40
POLB P06746 1/20 0.40
RECQL P46063 1/20 0.40
CYP2B6 P20813 1/20 0.37
TENT4A Q5XG87 1/20 0.37
TENT4B Q8NDF8 1/20 0.37
KMT2A Q03164 1/20 0.37
KDM4E B2RXH2 1/20 0.37

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
SCHEMBL15485807 0.91 ALDH1A1 (0.47) CNR2TYRALDH1A1CNR1LMNA
SCHEMBL843837 0.82 CNR2 (0.60) CNR2TYRALDH1A1CNR1KMT2A
SCHEMBL859046 0.77 CNR2 (0.78) CNR2CNR1LMNA
SCHEMBL11557176 0.77 ALDH1A1 (0.53) CNR2TYRALDH1A1HTTLMNA
SCHEMBL859045 0.76 CNR2 (0.79) CNR2CNR1
SCHEMBL844142 0.75 ALDH1A1 (0.46) CNR2TYRALDH1A1LMNAPOLB
SCHEMBL25062490 0.72 NOTUM (0.51) ALDH1A1HTTLMNAKMT2AKDM4E
SCHEMBL11555438 0.72 ALDH1A1 (0.48) CNR2TYRALDH1A1LMNAPOLB
SCHEMBL15485636 0.71 LMNA (0.46) ALDH1A1LMNAPOLBRECQLCYP2B6
SCHEMBL15486289 0.71 LMNA (0.46) ALDH1A1LMNAPOLBRECQLCYP2B6

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
US-20120149735-A1 1,4-Dihydropyridine Derivatives and Their Uses CENTRE HOSPITALIER REGIONAL UNIVERSITAIRE DE LILLE (FR) 2012-06-14 US disclosed
EP-2432763-A1 1,4 DIHYDROPYRIDINE DERIVATIVES AND THEIR USES Université de Lille 2 Droit et Santé (FR) 2012-03-28 EP disclosed
WO-2010133973-A1 1,4 DIHYDROPYRIDINE DERIVATIVES AND THEIR USES UNIVERSITE LILLE 2 DROIT ET SANTE (FR) 2010-11-25 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-20120149735-A1 1,4-Dihydropyridine Derivatives and Their Uses CNR2, CNR1, TRPV1 CNR2 1/4885TYR 2630/4885ALDH1A1 575/4885

“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.