SCHEMBL10139707

SCHEMBL10139707

CC(C)(C)OC(=O)N1C2CCC1C(c1cnc(N)c(-c3cccnc3)c1)C2

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 3/20 0.40
KIT P10721 1/20 0.39
CHEK2 O96017 1/20 0.38
MAPK1 P28482 1/20 0.37
CCNA2 P20248 1/20 0.36
CDK2 P24941 1/20 0.36
CHRM2 P08172 1/20 0.36
CHRM1 P11229 1/20 0.36
CHRM3 P20309 1/20 0.36
CHRNB2 P17787 1/20 0.36
CHRNA6 Q15825 1/20 0.36
CHKA P35790 1/20 0.36
GBA1 P04062 1/20 0.35
HDAC1 Q13547 1/20 0.35

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
SCHEMBL15006984 0.91 GPR119 (0.38) GPR119CHEK2MAPK1CHRM2CHRM1
SCHEMBL10139212 0.90 CHRM2 (0.38) GPR119CHRM2CHRM1CHRM3
SCHEMBL15024919 0.88 GPR119 (0.37) GPR119CHRM2CHRM1CHRM3HDAC1
SCHEMBL15006940 0.87 CHRNB2 (0.43) CHEK2CHRNB2CHKAHDAC1
SCHEMBL15024744 0.87 WNT3A (0.41) GPR119CHRM2CHRM1CHRM3HDAC1
SCHEMBL15006726 0.86 CHRNB2 (0.43) CHRM2CHRM1CHRM3CHRNB2
SCHEMBL10138721 0.86 UCHL1 (0.36) GPR119MAPK1CHRM2CHRM1CHRM3
SCHEMBL10138718 0.86 CHRNB2 (0.36) GPR119CHRM2CHRM1CHRM3CHRNB2
SCHEMBL10139708 0.86 CHEK2 (0.42) GPR119CHEK2CHRNB2
SCHEMBL10138669 0.86 CHRM2 (0.36) GPR119CHRM2CHRM1CHRM3CHRNB2

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
EP-2606052-B1 NICOTINIC RECEPTOR COMPOUNDS RES TRIANGLE INST (US) 2016-06-01 EP disclosed
US-9284322-B2 Nicotinic receptor compounds RESEARCH TRIANGLE INSTITUTE (US) 2016-03-15 US disclosed
US-20150152119-A1 NICOTINIC RECEPTOR COMPOUNDS RES TRIANGLE INST (US) 2015-06-04 US disclosed
WO-2012024615-A1 NICOTINIC RECEPTOR COMPOUNDS RESEARCH TRIANGLE INSTITUTE (US) 2012-02-23 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-20150152119-A1 NICOTINIC RECEPTOR COMPOUNDS CHRNG, CHRNA7, CHRNA2 GPR119 49/4885KIT 3062/4885CHEK2 2159/4885

“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.