SCHEMBL3586943

SCHEMBL3586943

CC(C)(C)OC(=O)N1CCc2nc(-c3ccc(OCCCCl)cc3)sc2CC1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
GRAMD1A Q96CP6 1/20 0.43
GPR119 Q8TDV5 9/20 0.43
PPARD Q03181 2/20 0.42
PPARA Q07869 2/20 0.42
GCK P35557 1/20 0.41
PDE3B Q13370 1/20 0.40
PDE3A Q14432 1/20 0.40
FGFR3 P22607 1/20 0.40
KDR P35968 1/20 0.40
CHEK2 O96017 1/20 0.40

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
SCHEMBL3574338 0.93 GRAMD1A (0.50) NPC1RAB9AGRAMD1AGPR119GCK
SCHEMBL3582423 0.82 NPC1 (0.43) NPC1RAB9APPARDPPARA
SCHEMBL3577700 0.82 NPC1 (0.53) NPC1RAB9APPARDPPARAGCK
SCHEMBL8858771 0.82 NPC1 (0.47) NPC1RAB9AGRAMD1AGPR119FGFR3
SCHEMBL3578989 0.80 NPC1 (0.48) NPC1RAB9APPARDPPARAFGFR3
SCHEMBL15166578 0.79 GCK (0.51) NPC1RAB9AGPR119GCKFGFR3
SCHEMBL3587709 0.79 HRH3 (0.55)
SCHEMBL3582608 0.79 HRH3 (0.55)
SCHEMBL3581201 0.79 NPC1 (0.55) NPC1RAB9APPARDPPARA
SCHEMBL3586370 0.78 NPC1 (0.52) NPC1RAB9APPARDPPARA

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
US-20100009969-A1 Fused Oxazoles & Thiazoles As Histamine H3- Receptor Ligands UCB PHARMA, S.A. (BE) 2010-01-14 US disclosed
US-20100009969-A1 Fused Oxazoles & Thiazoles As Histamine H3- Receptor Ligands UCB PHARMA, S.A. (BE) 2010-01-14 US disclosed
US-20100009969-A1 Fused Oxazoles & Thiazoles As Histamine H3- Receptor Ligands UCB PHARMA, S.A. (BE) 2010-01-14 US disclosed
WO-2008012010-A1 FUSED OXAZOLES & THIAZOLES AS HISTAMINE H3- RECEPTOR LIGANDS UCB PHARMA, S.A. (BE) 2008-01-31 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-20100009969-A1 Fused Oxazoles & Thiazoles As Histamine H3- Receptor Ligands HRH3, HRH4, HRH2 NPC1 3536/4885RAB9A 3681/4885GRAMD1A 4049/4885

“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.