SCHEMBL4082457

SCHEMBL4082457

Cn1cc(C#N)cc1-c1csc(NC(C)(C)CO)n1

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
VCP P55072 2/20 0.35
KDM4E B2RXH2 3/20 0.32
MAPT P10636 4/20 0.32
LMNA P02545 3/20 0.32
CFTR P13569 1/20 0.31
TRPV4 Q9HBA0 1/20 0.31
RORC P51449 1/20 0.31
MEN1 O00255 3/20 0.30
KMT2A Q03164 3/20 0.30
MRE11 P49959 2/20 0.30
GAA P10253 1/20 0.30
HTT P42858 1/20 0.30
TYR P14679 1/20 0.30
PIK3CG P48736 1/20 0.30
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
IRAK4 Q9NWZ3 1/20 0.30
MAPK1 P28482 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL4087254 0.80 VCP (0.35) VCPKDM4EMAPTLMNACFTR
SCHEMBL3175801 0.77 VCP (0.58) VCPKDM4EMAPTLMNACFTR
SCHEMBL3166410 0.76 CYP1A1 (0.51) VCPKDM4EMAPTCFTRMEN1
Hydrochloric Acid SCHEMBL4075479 0.74 VCP (0.38) VCPKDM4EMAPTLMNACFTR
SCHEMBL4083643 0.70 PIK3CG (0.39) VCPKDM4ELMNATRPV4PIK3CG
Hydrochloric Acid SCHEMBL4078444 0.70 PIK3CG (0.38) VCPKDM4ELMNATRPV4PIK3CG
SCHEMBL3527848 0.70 SIRT5 (0.48) VCPMEN1KMT2ARAB9A
SCHEMBL4077729 0.65 MAPT (0.59) KDM4EMAPTLMNAMEN1KMT2A
SCHEMBL4078682 0.64 MEN1 (0.52) VCPMAPTMEN1KMT2AGAA
SCHEMBL3166865 0.64 MAOA (0.54) VCPKDM4EMAPTCFTRMEN1

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-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 VCP 2712/4885KDM4E 480/4885MAPT 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.