SCHEMBL14719201

SCHEMBL14719201

O=C(O)N1CCN(c2nc3ccc(Br)cc3s2)CC1

nearest known ligand 0.79

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 11/20 0.79
NPC1 O15118 9/20 0.79
MAPT P10636 8/20 0.68
HTT P42858 2/20 0.68
ALDH1A1 P00352 2/20 0.68
SMN1; SMN2 Q16637 3/20 0.68
STAT3 P40763 1/20 0.55
TP53 P04637 4/20 0.55
LMNA P02545 2/20 0.54
MEN1 O00255 1/20 0.52
MAPK1 P28482 1/20 0.52
KMT2A Q03164 1/20 0.52

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
SCHEMBL26684066 0.90 RAB9A (0.64) RAB9ANPC1MAPTHTTALDH1A1
SCHEMBL27940617 0.85 AR (0.65) RAB9ANPC1MAPTHTTALDH1A1
SCHEMBL27727271 0.84 NPC1 (0.74) RAB9ANPC1MAPTSMN1; SMN2TP53
SCHEMBL2591810 0.82 RAB9A (0.74) RAB9ANPC1MAPTHTTALDH1A1
SCHEMBL3097838 0.81 ALDH1A1 (0.61) RAB9ANPC1MAPTHTTALDH1A1
SCHEMBL14852353 0.81 RAB9A (0.76) RAB9ANPC1MAPTHTTALDH1A1
SCHEMBL1981263 0.78 RAB9A (0.76) RAB9ANPC1MAPTHTTALDH1A1
SCHEMBL21114767 0.78 RAB9A (0.76) RAB9ANPC1MAPTHTTALDH1A1
SCHEMBL3468742 0.77 RAB9A (0.70) RAB9ANPC1MAPTHTTALDH1A1
SCHEMBL26828990 0.76 NAAA (0.80) RAB9ANPC1

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 RAB9A 579/4885NPC1 967/4885MAPT 1165/4885

“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.