SCHEMBL5861898

SCHEMBL5861898

C=CCOC(=O)C1CNC(=O)O1

nearest known ligand 0.33

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.33
ERN1 O75460 1/20 0.32
TSHR P16473 4/20 0.32
TP53 P04637 2/20 0.32
POLB P06746 2/20 0.32
MAPK1 P28482 1/20 0.32
GAA P10253 3/20 0.32
RECQL P46063 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
MAPT P10636 1/20 0.32
ALDH1A1 P00352 3/20 0.31
HPGD P15428 2/20 0.31
HSD17B10 Q99714 2/20 0.31
USP2 O75604 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
KDM4E B2RXH2 1/20 0.30

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
SCHEMBL28624832 0.77 CYP3A4 (0.37) CYP3A4ERN1TSHRTP53POLB
SCHEMBL18166942 0.73 TSHR (0.38) CYP3A4ERN1TSHRTP53POLB
SCHEMBL18305953 0.73 CHRNB2 (0.36)
SCHEMBL19872812 0.73 CHRNB2 (0.36)
SCHEMBL1580236 0.72
SCHEMBL1107544 0.72 LMNA (0.55) TSHRMAPK1GAAALDH1A1L3MBTL1
SCHEMBL28443036 0.71 ALDH1A1 (0.36) CYP3A4TSHRTP53POLBMAPK1
SCHEMBL27814476 0.69 ALDH1A1 (0.36) CYP3A4ERN1TSHRTP53POLB
SCHEMBL18166954 0.69 CYP3A4 (0.39) CYP3A4ERN1TSHRTP53POLB
SCHEMBL11198413 0.69

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-7012088-B2 Indolone oxazolidinones and derivatives thereof PHARMACIA & UPJOHN COMPANY (US) 2006-03-14 US disclosed
EP-1599470-A1 ANTIBACTERIAL INDOLONE OXAZOLIDINONES, INTERMEDIATES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM Pharmacia & Upjohn Company LLC (US) 2005-11-30 EP disclosed
US-20040176610-A1 Indolone oxazolidinones and derivatives thereof PHARMACIA & UPJOHN COMPANY 2004-09-09 US disclosed
WO-2004074282-A1 ANTIBACTERIAL INDOLONE OXAZOLIDINONES, INTERMEDIATES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM PHARMACIA & UPJOHN COMPANY LLC (US) 2004-09-02 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-20040176610-A1 Indolone oxazolidinones and derivatives thereof OXA1L, IDO1, NDUFS7 CYP3A4 130/4885ERN1 3118/4885TSHR 3233/4885

“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.