SCHEMBL3974593

SCHEMBL3974593

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

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 3/20 0.49
HTT P42858 2/20 0.49
MAPT P10636 2/20 0.49
PIK3CD O00329 1/20 0.40
PIK3CA P42336 1/20 0.40
PIK3CG P48736 1/20 0.40
AR P10275 1/20 0.39
CFTR P13569 2/20 0.38
ALDH1A1 P00352 3/20 0.36
IDH1 O75874 8/20 0.36
NPC1 O15118 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35

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
SCHEMBL3971702 0.85 PIK3CD (0.38) NPSR1HTTMAPTPIK3CDPIK3CA
SCHEMBL4075018 0.77 SMN1; SMN2 (0.51) NPSR1HTTMAPTARALDH1A1
SCHEMBL4078359 0.77 IDH1 (0.39) MAPTPIK3CDPIK3CAPIK3CGIDH1
SCHEMBL4086084 0.72 PIK3CD (0.38) MAPTPIK3CDPIK3CAPIK3CGAR
SCHEMBL4077257 0.72 PIK3CD (0.39) MAPTPIK3CDPIK3CAPIK3CGAR
SCHEMBL4078919 0.70 DHODH (0.41) MAPTPIK3CDPIK3CAPIK3CGALDH1A1
SCHEMBL4087581 0.68 AR (0.52) NPSR1HTTMAPTARALDH1A1
SCHEMBL4076522 0.66 MAPT (0.47) MAPTARALDH1A1NPC1SMN1; SMN2
SCHEMBL4077526 0.65 PTPN1 (0.37) MAPTPIK3CDPIK3CAPIK3CGAR
SCHEMBL4076674 0.64 MAPT (0.52) HTTMAPTARALDH1A1NPC1

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 NPSR1 124/4885HTT 2137/4885MAPT 1550/4885

“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.