SCHEMBL843837

SCHEMBL843837

CCCCCn1cc(C(=O)O)c(=O)cc1C

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 11/20 0.60
TYR P14679 2/20 0.59
CNR1 P21554 3/20 0.47
ALDH1A1 P00352 1/20 0.47
CYP1A2 P05177 3/20 0.46
CYP2C19 P33261 3/20 0.46
GAA P10253 1/20 0.46
MEN1 O00255 1/20 0.46
CYP2C9 P11712 1/20 0.46
KMT2A Q03164 1/20 0.46
TDP1 Q9NUW8 1/20 0.46

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
SCHEMBL844095 0.82 CNR2 (0.46) CNR2TYRCNR1ALDH1A1KMT2A
SCHEMBL11557176 0.82 ALDH1A1 (0.53) CNR2TYRALDH1A1CYP1A2MEN1
SCHEMBL3413416 0.81 CNR2 (0.69) CNR2CNR1CYP1A2CYP2C19GAA
SCHEMBL9895235 0.81 CNR2 (0.68) CNR2TYRCNR1
SCHEMBL843912 0.79 CNR2 (0.67) CNR2CNR1
SCHEMBL15485807 0.79 ALDH1A1 (0.47) CNR2TYRCNR1ALDH1A1
SCHEMBL10990871 0.78 CNR2 (0.66) CNR2CNR1
SCHEMBL859522 0.78 CNR2 (0.66) CNR2CNR1
SCHEMBL9895297 0.77 CNR2 (0.70) CNR2TYRCNR1
SCHEMBL9895701 0.77 CNR2 (0.74) CNR2TYRCNR1

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-20120149735-A1 1,4-Dihydropyridine Derivatives and Their Uses CENTRE HOSPITALIER REGIONAL UNIVERSITAIRE DE LILLE (FR) 2012-06-14 US disclosed
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 2630/4885CNR1 2/4885

“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.