SCHEMBL3971702

SCHEMBL3971702

Cc1sc(N2C(=O)OCC2(C)C)nc1-c1ccc(C#N)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 1/20 0.38
PIK3CA P42336 1/20 0.38
PIK3CG P48736 1/20 0.38
AR P10275 1/20 0.37
MAPT P10636 3/20 0.36
MEN1 O00255 1/20 0.36
GAA P10253 1/20 0.36
RECQL P46063 1/20 0.36
KMT2A Q03164 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
ALOX5 P09917 1/20 0.36
PTGS2 P35354 1/20 0.36
NPSR1 Q6W5P4 3/20 0.35
ALDH1A1 P00352 3/20 0.35
HTT P42858 2/20 0.34
IDH1 O75874 2/20 0.34
KDM4C Q9H3R0 1/20 0.34
PTPN11 Q06124 1/20 0.34
NPC1 O15118 1/20 0.34
SMN1; SMN2 Q16637 2/20 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
SCHEMBL4077257 0.88 PIK3CD (0.39) PIK3CDPIK3CAPIK3CGARMAPT
SCHEMBL4086084 0.88 PIK3CD (0.38) PIK3CDPIK3CAPIK3CGARMAPT
SCHEMBL3974593 0.85 NPSR1 (0.49) PIK3CDPIK3CAPIK3CGARMAPT
SCHEMBL4078988 0.78 GAA (0.55) ARMAPTMEN1GAARECQL
SCHEMBL4079104 0.78 IDH1 (0.38) ARMAPTMEN1GAARECQL
SCHEMBL4073483 0.75 PIK3CD (0.46) PIK3CDPIK3CAPIK3CGMAPTMEN1
SCHEMBL4080191 0.74 ALOX5 (0.35) ARMAPTMEN1GAARECQL
SCHEMBL3973340 0.74 PTGDR2 (0.35) PIK3CDPIK3CAPIK3CGARMAPT
SCHEMBL4075313 0.74 TP53 (0.39) ARMAPTMEN1GAARECQL
SCHEMBL4407646 0.72 STS (0.34) PIK3CDPIK3CAPIK3CGIDH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7618990-B2 4-[2-(4,4-Dimethyl-2-thioxo-1,3-oxazolidin-3-yl)-1,3-thiazol-4-yl]benzonitrile; progesterone receptor (PR); contraception, treating or preventing fibroids, endometriosis, dysfunctional bleeding, uterine leiomyomata, polycystic ovary syndrome, or hormone-dependent carcinomas, hormone replacement therapy WYETH (US) 2009-11-17 US claimed
EP-2054410-A2 OXAZOLIDONE DERIVATIVES AS PR MODULATORS Wyeth (US) 2009-05-06 EP claimed
US-20080045556-A1 Oxazolidone derivatives as PR modulators WYETH (US) 2008-02-21 US claimed
WO-2008021331-A2 OXAZOLIDONE DERIVATIVES AS PR MODULATORS WYETH (US) 2008-02-21 WO claimed
US-7618990-B2 4-[2-(4,4-Dimethyl-2-thioxo-1,3-oxazolidin-3-yl)-1,3-thiazol-4-yl]benzonitrile; progesterone receptor (PR); contraception, treating or preventing fibroids, endometriosis, dysfunctional bleeding, uterine leiomyomata, polycystic ovary syndrome, or hormone-dependent carcinomas, hormone replacement therapy WYETH (US) 2009-11-17 US disclosed
EP-2054410-A2 OXAZOLIDONE DERIVATIVES AS PR MODULATORS Wyeth (US) 2009-05-06 EP disclosed
US-20080045556-A1 Oxazolidone derivatives as PR modulators WYETH (US) 2008-02-21 US disclosed
WO-2008021331-A2 OXAZOLIDONE DERIVATIVES AS PR MODULATORS WYETH (US) 2008-02-21 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-20080045556-A1 Oxazolidone derivatives as PR modulators MC2R, NPY1R, PRLHR PIK3CD 4187/4885PIK3CA 3496/4885PIK3CG 4308/4885

“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.