SCHEMBL7918388

SCHEMBL7918388

C=CCCCCC1Cn2c(nc3cnccc32)O1

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PTAFR P25105 1/20 0.34
CYP2D6 P10635 2/20 0.31
DPP4 P27487 2/20 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
SCHEMBL2220997 0.85 KDM4E (0.35)
SCHEMBL2220435 0.85 KDM4E (0.35)
SCHEMBL2219155 0.84 PTAFR (0.48) PTAFR
SCHEMBL7927257 0.81 GRM2 (0.32)
SCHEMBL7915024 0.81 GRM2 (0.32)
SCHEMBL1512020 0.79 CYP2D6 (0.36) PTAFRCYP2D6DPP4
SCHEMBL12441129 0.78 GRM2 (0.35)
SCHEMBL1511845 0.70 LMNA (0.42) PTAFRCYP2D6
SCHEMBL7922204 0.69 GRM2 (0.46)
SCHEMBL8007560 0.68 SMN1; SMN2 (0.34) CYP2D6DPP4

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-20110178117-A1 OXAZOLOBENZIMIDAZOLE DERIVATIVES MERCK SHARP & DOHME CORP. (US) 2011-07-21 US disclosed
US-20110178117-A1 OXAZOLOBENZIMIDAZOLE DERIVATIVES MERCK SHARP & DOHME CORP. (US) 2011-07-21 US disclosed
WO-2010036544-A1 OXAZOLOBENZIMIDAZOLE DERIVATIVES MERCK SHARP & DOHME CORP. (US) 2010-04-01 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-20110178117-A1 OXAZOLOBENZIMIDAZOLE DERIVATIVES GRM2, GRM1, GRM3 PTAFR 1620/4885CYP2D6 2440/4885DPP4 858/4885

“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.