SCHEMBL10001459

SCHEMBL10001459

Cc1ccc(C(=O)NC[C@H](O)CNc2ccc(N3CCOCC3=O)cc2)s1

nearest known ligand 0.65

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
F10 P00742 19/20 0.65
CYP1A2 P05177 1/20 0.65
CYP3A4 P08684 1/20 0.65
CYP2D6 P10635 1/20 0.65
CYP2C9 P11712 1/20 0.65
CYP2C19 P33261 1/20 0.65
ABCB11 O95342 1/20 0.51
F2 P00734 1/20 0.51
ST14 Q9Y5Y6 1/20 0.51
PTGS2 P35354 1/20 0.46

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
SCHEMBL78971 0.89 F10 (0.67) F10CYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL2233431 0.89 F10 (0.67) F10CYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL3276611 0.89 F10 (0.67) F10CYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL15203331 0.84 F10 (0.47) F10CYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL14838660 0.83 F10 (0.49) F10CYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL12869930 0.82 F10 (0.58) F10CYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL18843493 0.82 F10 (0.58) F10CYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL80372 0.81 F10 (0.66) F10ABCB11F2ST14
SCHEMBL14838626 0.81 F10 (0.67) F10CYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL17897808 0.80 F10 (0.56) F10CYP1A2CYP3A4CYP2D6CYP2C9

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-8106192-B2 Method for producing 5-chloro-N-({(5S)-2-oxo-3-[4-(3-oxo-4-morpholinyl)phenyl]-1,3-oxazolidin-5-yl}methyl)-2-thiophenecarboxamide BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2012-01-31 US disclosed
US-20100081807-A1 METHOD FOR PRODUCING 5-CLORO-N-(METHYL)-2-THIOPHENECARBOXAMIDE BAYER HEALTHCARE AG (DE) 2010-04-01 US disclosed
US-20070149522-A1 Method for producing 5-chloro-n-({(5s)-2-oxo-3-[4-(3-oxo-4-morpholinyl)phenyl]-1,3-oxazolidin-5-yl}methyl)-2-thiophenecarboxamide BAYER HEALTHCARE AG (DE) 2007-06-28 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 (2 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-20070149522-A1 Method for producing 5-chloro-n-({(5s)-2-oxo-3-[4-(3-oxo-4-morpholinyl)phenyl]-1,3-oxazolidin-5-yl}methyl)-2-thiophenecarboxamide NT5C, NOX5, MT-ND5 F10 4544/4885CYP1A2 234/4885CYP3A4 339/4885
US-20100081807-A1 METHOD FOR PRODUCING 5-CLORO-N-(METHYL)-2-THIOPHENECARBOXAMIDE CBR3, NT5C, CBR1 F10 4090/4885CYP1A2 174/4885CYP3A4 170/4885

“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.