SCHEMBL14729145

SCHEMBL14729145

C=C(c1csnn1)N1CCC(Oc2nc3ccc(C4=CCN(S(=O)(=O)CCC)CC4)cc3s2)CC1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 14/20 0.43
CCNT1 O60563 1/20 0.33
CDK9 P50750 1/20 0.33
MMP2 P08253 2/20 0.32
MMP3 P08254 2/20 0.32
ACACB O00763 1/20 0.31
LIPC P11150 1/20 0.31
LIPG Q9Y5X9 1/20 0.31

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
SCHEMBL14728908 0.92 GPR119 (0.45) GPR119CCNT1CDK9MMP2MMP3
SCHEMBL14729137 0.86 GPR119 (0.48) GPR119CCNT1CDK9MMP2MMP3
SCHEMBL14728891 0.86 GPR119 (0.49) GPR119MMP2MMP3ACACBLIPC
SCHEMBL2594495 0.86 GPR119 (0.49) GPR119MMP2MMP3
SCHEMBL14728890 0.86 GPR119 (0.52) GPR119CCNT1CDK9MMP2MMP3
SCHEMBL14728884 0.85 GPR119 (0.50) GPR119CCNT1CDK9MMP2MMP3
SCHEMBL14728887 0.85 GPR119 (0.48) GPR119
SCHEMBL14728898 0.84 GPR119 (0.60) GPR119
SCHEMBL14728894 0.84 GPR119 (0.49) GPR119MMP2MMP3
SCHEMBL14728886 0.84 GPR119 (0.51) GPR119MMP2MMP3ACACBLIPC

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 2 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
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 GPR119 1/4885CCNT1 3482/4885CDK9 904/4885

“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.