SCHEMBL8250488

SCHEMBL8250488

O=c1[nH]c2ccc(OC(F)F)cc2n1C1CCNCC1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 8/20 0.49
PGR P06401 9/20 0.46
OPRL1 P41146 1/20 0.42
HTR3A P46098 1/20 0.41
HTR4 Q13639 1/20 0.41
CHRM2 P08172 1/20 0.41
CHRM4 P08173 1/20 0.41
CHRM5 P08912 1/20 0.41
CHRM1 P11229 1/20 0.41
CHRM3 P20309 1/20 0.41
KCNH2 Q12809 1/20 0.41

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
Hydrochloric Acid SCHEMBL4636657 0.99 OPRM1 (0.48) OPRM1PGROPRL1HTR3AHTR4
SCHEMBL4669069 0.88 OPRM1 (0.54) OPRM1PGROPRL1CHRM2CHRM4
SCHEMBL607661 0.85 OPRM1 (0.56) OPRM1PGRCHRM2CHRM4CHRM5
Hydrochloric Acid SCHEMBL606145 0.84 OPRM1 (0.55) OPRM1PGRCHRM2CHRM4CHRM5
SCHEMBL4307479 0.84 OPRM1 (0.51) OPRM1PGROPRL1HTR3AHTR4
SCHEMBL31285927 0.84 OPRM1 (0.51) OPRM1PGROPRL1HTR3AHTR4
SCHEMBL4637224 0.81 CHRM1 (0.67) OPRM1OPRL1CHRM2CHRM4CHRM5
SCHEMBL4635947 0.81 CCR5 (0.49) OPRM1CHRM2CHRM4CHRM5CHRM1
SCHEMBL5385477 0.81 OPRM1 (0.53) OPRM1PGRCHRM2CHRM4CHRM5
Hydrochloric Acid SCHEMBL4635701 0.80 CHRM1 (0.66) OPRM1OPRL1CHRM2CHRM4CHRM5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8288413-B2 Benzimidazolones which have activity at M1 receptor GLAXO GROUP LIMITED (GB) 2012-10-16 US disclosed
US-8288413-B2 Benzimidazolones which have activity at M1 receptor GLAXO GROUP LIMITED (GB) 2012-10-16 US disclosed
US-20080306112-A1 Benzimidazolones Which Have Activity at M1 Receptor GLAXO GROUP LIMITED (GB) 2008-12-11 US disclosed
US-20080306112-A1 Benzimidazolones Which Have Activity at M1 Receptor GLAXO GROUP LIMITED (GB) 2008-12-11 US disclosed
WO-2007036711-A1 BENZIMIDAZOLONES WHICH HAVE ACTIVITY AT Ml RECEPTOR GLAXO GROUP LIMITED (GB) 2007-04-05 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-20080306112-A1 Benzimidazolones Which Have Activity at M1 Receptor CHRM1, CHRM2, CHRM4 OPRM1 11/4885PGR 788/4885OPRL1 64/4885

“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.