SCHEMBL4087581

SCHEMBL4087581

Cc1ccc(-c2csc(N3C(=O)OCC3(C)C)n2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 6/20 0.52
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
ATM Q13315 1/20 0.50
KAT2B Q92831 1/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
MAPT P10636 6/20 0.42
KMT2A Q03164 6/20 0.42
MEN1 O00255 5/20 0.42
TDP1 Q9NUW8 4/20 0.42
GAA P10253 4/20 0.42
BLM P54132 2/20 0.42
POLB P06746 2/20 0.42
HTT P42858 2/20 0.42
KDM4E B2RXH2 1/20 0.42
ALOX12 P18054 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
PDE3B Q13370 1/20 0.41
PDE3A Q14432 1/20 0.41
RECQL P46063 2/20 0.41

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
SCHEMBL4077609 0.89 MAPT (0.52) ARNPC1RAB9ASMN1; SMN2MAPT
SCHEMBL4075018 0.89 SMN1; SMN2 (0.51) ARNPC1RAB9ASMN1; SMN2MAPT
SCHEMBL4076674 0.89 MAPT (0.52) ARNPC1RAB9ASMN1; SMN2MAPT
SCHEMBL3977547 0.89 MEN1 (0.48) ARNPC1RAB9ASMN1; SMN2MAPT
SCHEMBL4075308 0.88 MEN1 (0.50) ARNPC1RAB9ASMN1; SMN2MAPT
SCHEMBL4078198 0.86 AR (0.54) ARNPC1RAB9ASMN1; SMN2MAPT
SCHEMBL4077640 0.86 MEN1 (0.38) ARNPC1RAB9AATMSMN1; SMN2
SCHEMBL4076268 0.85 SMN1; SMN2 (0.51) ARNPC1RAB9AATMSMN1; SMN2
SCHEMBL4080394 0.85 RAB9A (0.57) ARNPC1RAB9ASMN1; SMN2MAPT
SCHEMBL4484758 0.85 SIRT5 (0.42) ARNPC1RAB9AMAPTKMT2A

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 7 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
US-20080045556-A1 Oxazolidone derivatives as PR modulators WYETH (US) 2008-02-21 US 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
CN-101501031-A Oxazolidone derivatives as pr modulators WYETH CORP (US) 2009-08-05 CN 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 AR 47/4885NPC1 4830/4885RAB9A 1677/4885

“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.