SCHEMBL3392866

SCHEMBL3392866

Cn1nnc([C@@H](NC(=O)O)C(C)(C)C)n1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 3/20 0.44
CNR1 P21554 1/20 0.44
TSHR P16473 2/20 0.38
NPC1 O15118 2/20 0.36
SMN1; SMN2 Q16637 3/20 0.35
TP53 P04637 2/20 0.35
RAB9A P51151 2/20 0.35
RECQL P46063 2/20 0.35
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 2/20 0.33

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
SCHEMBL3388325 0.72 CNR2 (0.43) CNR2NPC1SMN1; SMN2RAB9ARECQL
SCHEMBL2781606 0.69 NAALAD2 (0.48) CNR2SMN1; SMN2RECQLALDH1A1
SCHEMBL2574650 0.66 CNR2 (0.45) CNR2
SCHEMBL1284717 0.66 ALDH1A1 (0.34) NPC1SMN1; SMN2TP53RAB9AKDM4E
SCHEMBL11983465 0.65 TSHR (0.44) TSHRNPC1SMN1; SMN2TP53RAB9A
SCHEMBL1051798 0.63 LMNA (0.35) TSHRTP53KDM4EALDH1A1
SCHEMBL2780999 0.61 CNR2 (0.34) CNR2TSHR
SCHEMBL24050457 0.60 KDM4E (0.37) TSHRSMN1; SMN2RECQLKDM4EALDH1A1
SCHEMBL5618142 0.60 TSHR (0.40) TSHRNPC1SMN1; SMN2TP53RAB9A
SCHEMBL17467130 0.59 GABRP (0.35) NPC1SMN1; SMN2RAB9AKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1861377-B1 BENZIMIDAZOLONE DERIVATIVES AS CB2 RECEPTOR LIGANDS PFIZER (US) 2010-12-29 EP disclosed
US-20090298811-A1 BENZIMIDAZOLONE DERIVATIVES PFIZER INC 2009-12-03 US disclosed
EP-2114897-A2 BENZIMIDAZOLONE DERIVATIVES Pfizer Products Inc. (US) 2009-11-11 EP disclosed
US-20090181957-A1 BENZIMIDAZOLONE DERIVATIVES AS CB2 RECEPTOR LIGANDS ANDO KAZUO 2009-07-16 US disclosed
WO-2008032164-A2 BENZIMIDAZOLONE DERIVATIVES PFIZER PRODUCTS INC. (US) 2008-03-20 WO disclosed
EP-1861377-A1 BENZIMIDAZOLONE DERIVATIVES AS CB2 RECEPTOR LIGANDS Pfizer, Inc. (US) 2007-12-05 EP disclosed
WO-2006097808-A1 BENZIMIDAZOLONE DERIVATIVES AS CB2 RECEPTOR LIGANDS PFIZER JAPAN INC. (JP) 2006-09-21 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-20090298811-A1 BENZIMIDAZOLONE DERIVATIVES TRPV1, CNR1, CNR2 CNR2 3/4885CNR1 2/4885TSHR 350/4885
US-20090181957-A1 BENZIMIDAZOLONE DERIVATIVES AS CB2 RECEPTOR LIGANDS TRPV1, CNR1, CNR2 CNR2 3/4885CNR1 2/4885TSHR 405/4885

“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.