SCHEMBL14719113

SCHEMBL14719113

O=C(O)N1CCC(c2ccc3nc(OC4CCN(c5ncc(Cl)cn5)CC4)sc3c2)CC1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SCD O00767 2/20 0.39
MAPT P10636 3/20 0.37
NPC1 O15118 1/20 0.37
MAPK1 P28482 1/20 0.37
GPR119 Q8TDV5 3/20 0.36
MCHR1 Q99705 1/20 0.34
ACACB O00763 1/20 0.34
CNR2 P34972 1/20 0.34
TP53 P04637 1/20 0.34
POLB P06746 1/20 0.34
CCR1 P32246 1/20 0.34
CHRM5 P08912 1/20 0.34
PPARG P37231 1/20 0.34
PPARD Q03181 1/20 0.34
PPARA Q07869 1/20 0.34

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
SCHEMBL2592912 0.89 GPR119 (0.44) MAPTGPR119MCHR1TP53
SCHEMBL2594247 0.85 GPR119 (0.36) SCDNPC1GPR119
SCHEMBL2590794 0.82 GPR119 (0.39) SCDMAPTNPC1MAPK1GPR119
SCHEMBL2589080 0.81 GPR119 (0.39) SCDMAPTNPC1MAPK1GPR119
SCHEMBL2592954 0.81 ACACB (0.38) ACACB
SCHEMBL14729056 0.80 GPR119 (0.40) SCDMAPTNPC1MAPK1GPR119
SCHEMBL14729060 0.79 GPR119 (0.39) SCDMAPTNPC1MAPK1GPR119
SCHEMBL2591382 0.77 PDE4B (0.40) MAPTACACB
SCHEMBL2592856 0.75 GPR119 (0.46) MAPTNPC1MAPK1GPR119ACACB
SCHEMBL2589683 0.74 ACACB (0.55) MAPTNPC1ACACBTP53PPARA

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-8940716-B2 Bicyclic heteroaryl compounds as GPR119 modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2015-01-27 US disclosed
EP-2566860-B1 BICYCLIC HETEROARYL COMPOUNDS AS GPR119 MODULATORS BRISTOL MYERS SQUIBB CO (US) 2014-09-10 EP disclosed
US-20130053345-A1 BICYCLIC HETEROARLY ANALOGUES AS GPR119 MODULATORS BRISTOL-MYERS SQUIBB COMPANY 2013-02-28 US 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-20130053345-A1 BICYCLIC HETEROARLY ANALOGUES AS GPR119 MODULATORS GPR119, GPR139, GPR4 SCD 1621/4885MAPT 1165/4885NPC1 967/4885

“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.