SCHEMBL14749303

SCHEMBL14749303

CN1CCC(C2Cc3cc(Br)ccc3O2)CC1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 8/20 0.41
CHRM2 P08172 1/20 0.40
CHRM4 P08173 1/20 0.40
CHRM5 P08912 1/20 0.40
CHRM1 P11229 1/20 0.40
CHRM3 P20309 1/20 0.40
HRH3 Q9Y5N1 6/20 0.37
HRH4 Q9H3N8 1/20 0.37
MEN1 O00255 1/20 0.36
POLB P06746 1/20 0.36
HTT P42858 1/20 0.36
KMT2A Q03164 1/20 0.36
PBRM1 Q86U86 1/20 0.36
NOS3 P29474 1/20 0.35
NOS1 P29475 1/20 0.35
NOS2 P35228 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
SCHEMBL14749307 0.83 CHRM2 (0.36) GPR119CHRM2CHRM4CHRM5CHRM1
SCHEMBL2595915 0.81 PNMT (0.36) GPR119CHRM2CHRM4CHRM5CHRM1
SCHEMBL2595423 0.80 GPR119 (0.66) GPR119CHRM2
SCHEMBL14749306 0.79 GPR119 (0.35) GPR119CHRM2CHRM4CHRM5CHRM1
SCHEMBL9936121 0.79 GPR119 (0.47) GPR119
SCHEMBL9936136 0.79 GPR119 (0.56) GPR119CHRM2
SCHEMBL9936687 0.79 GPR119 (0.41) GPR119CHRM2CHRM4CHRM5CHRM1
SCHEMBL2595425 0.76 GPR119 (0.66) GPR119
SCHEMBL20334836 0.71 MEN1 (0.37) HRH3HRH4MEN1POLBHTT
SCHEMBL15724660 0.71 PBRM1 (0.60) PBRM1

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-8729084-B2 Benzofuranyl analogues as GPR119 modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2014-05-20 US disclosed
US-20130059858-A1 BENZOFURANYL ANALOGUES AS GPR119 MODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2013-03-07 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-20130059858-A1 BENZOFURANYL ANALOGUES AS GPR119 MODULATORS GPR119, GPR180, GPR139 GPR119 1/4885CHRM2 143/4885CHRM4 289/4885

“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.