SCHEMBL592146

SCHEMBL592146

COc1ccc2ncc(F)c(CNCCC[C@H]3CN(c4ccc5c(c4)NC(=O)CO5)C(=O)O3)c2c1

nearest known ligand 0.45

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 2/20 0.39
DRD2 P14416 1/20 0.38
DRD4 P21917 1/20 0.38
KCNH2 Q12809 3/20 0.38

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
SCHEMBL590313 1.00 GRM2 (0.39) GRM2DRD2DRD4KCNH2
SCHEMBL590312 1.00 GRM2 (0.39) GRM2DRD2DRD4KCNH2
SCHEMBL590956 0.88 KCNH2 (0.38) DRD2DRD4KCNH2
SCHEMBL591277 0.88 KCNH2 (0.38) DRD2DRD4KCNH2
SCHEMBL591513 0.88 KCNH2 (0.38) DRD2DRD4KCNH2
SCHEMBL592199 0.88 KCNH2 (0.38) DRD2DRD4KCNH2
SCHEMBL590345 0.88 KCNH2 (0.38) DRD2DRD4KCNH2
SCHEMBL591698 0.87 KCNH2 (0.48) KCNH2
SCHEMBL590289 0.87 KCNH2 (0.48) KCNH2
SCHEMBL590049 0.87 KCNH2 (0.40) GRM2KCNH2

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-8114867-B2 Oxazolidinone antibiotic derivatives ACTELION PHARMACEUTICALS LTD (CH) 2012-02-14 US disclosed
US-20100137290-A1 OXAZOLIDINONE ANTIBIOTIC DERIVATIVES ACTELION PHARMACEUTICALS LTD. (CH) 2010-06-03 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-20100137290-A1 OXAZOLIDINONE ANTIBIOTIC DERIVATIVES OXA1L, XDH, CCNY GRM2 4516/4885DRD2 152/4885DRD4 77/4885

“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.