SCHEMBL1222972

SCHEMBL1222972

COc1ccc2nccc(N3CC[C@](O)(CN)C3)c2n1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP8B1 Q9UNU6 1/20 0.38
KCNH2 Q12809 8/20 0.38
FLT3 P36888 2/20 0.37
SLC6A2 P23975 1/20 0.36
SLC6A4 P31645 1/20 0.36
SLC6A3 Q01959 1/20 0.36
PTPN11 Q06124 1/20 0.34
CYP2C8 P10632 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2B6 P20813 1/20 0.33
CYP2C19 P33261 1/20 0.33
HASPIN Q8TF76 1/20 0.33

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
SCHEMBL1222970 1.00 CYP8B1 (0.38) CYP8B1KCNH2FLT3SLC6A2SLC6A4
SCHEMBL4062836 0.87 KCNH2 (0.39) CYP8B1KCNH2
SCHEMBL1224748 0.81 KCNH2 (0.38) CYP8B1KCNH2
SCHEMBL1224745 0.81 KCNH2 (0.38) CYP8B1KCNH2
SCHEMBL4069340 0.75 KCNH2 (0.42) KCNH2
SCHEMBL4064105 0.75 CYP8B1 (0.41) CYP8B1KCNH2
SCHEMBL1222886 0.75 CYP8B1 (0.41) CYP8B1KCNH2
SCHEMBL1224184 0.74 CYP8B1 (0.41) CYP8B1KCNH2
SCHEMBL1224187 0.74 CYP8B1 (0.41) CYP8B1KCNH2
SCHEMBL4481543 0.74 CYP8B1 (0.38) CYP8B1KCNH2PTPN11

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2915813-A1 Oxazolidinone antibiotics Actelion Pharmaceuticals Ltd. (CH) 2015-09-09 EP disclosed
EP-2905283-A1 Oxazolidinone antibiotics Actelion Pharmaceuticals Ltd. (CH) 2015-08-12 EP disclosed
US-8217029-B2 Oxazolidinone antibiotics ACTELION PHARMACEUTICALS LTD (CH) 2012-07-10 US disclosed
US-20110039823-A1 OXAZOLIDINONE ANTIBIOTICS ACTELION PHARMACEUTICALS LTD (CH) 2011-02-17 US disclosed
EP-2144910-A2 OXAZOLIDINONE ANTIBIOTICS Actelion Pharmaceuticals Ltd. (CH) 2010-01-20 EP disclosed
WO-2008126034-A2 OXAZOLIDINONE ANTIBIOTICS ACTELION PHARMACEUTICALS LTD (CH) 2008-10-23 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-20110039823-A1 OXAZOLIDINONE ANTIBIOTICS OXA1L, XDH, UBE2D3 CYP8B1 902/4885KCNH2 912/4885FLT3 1332/4885

“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.