SCHEMBL4075394

SCHEMBL4075394

CC1CN(c2nc(-c3ccc(Br)cc3)cs2)C(=O)O1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.53
MAPT P10636 6/20 0.53
RAB9A P51151 5/20 0.53
MEN1 O00255 5/20 0.53
KMT2A Q03164 5/20 0.53
NPC1 O15118 4/20 0.53
MAPK1 P28482 2/20 0.53
LMNA P02545 1/20 0.53
CA1 P00915 1/20 0.53
CYP2C9 P11712 3/20 0.48
CYP2C19 P33261 3/20 0.48
CYP1A2 P05177 2/20 0.48
HPGD P15428 1/20 0.48
ALDH1A1 P00352 1/20 0.46
CYP2D6 P10635 1/20 0.46
ESR1 P03372 1/20 0.42
HTT P42858 1/20 0.42
EGFR P00533 4/20 0.42
MMP2 P08253 1/20 0.41
MMP8 P22894 1/20 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
SCHEMBL4074046 0.85 SMN1; SMN2 (0.53) SMN1; SMN2MAPTRAB9AMEN1KMT2A
SCHEMBL4078179 0.85 GAA (0.54) MAPTMEN1KMT2AEGFRSIRT5
SCHEMBL4079438 0.76 RAB9A (0.60) SMN1; SMN2MAPTRAB9AMEN1KMT2A
SCHEMBL3166808 0.76 RAB9A (0.50) SMN1; SMN2MAPTRAB9AMEN1KMT2A
SCHEMBL4075164 0.76 RAB9A (0.50) SMN1; SMN2MAPTRAB9AMEN1KMT2A
SCHEMBL4077340 0.76 RAB9A (0.50) SMN1; SMN2MAPTRAB9AMEN1KMT2A
SCHEMBL24852630 0.75 ALDH1A1 (0.46) MAPTMEN1KMT2ACYP2C9CYP2C19
SCHEMBL31192184 0.75 ALDH1A1 (0.46) MAPTMEN1KMT2ACYP2C9CYP2C19
SCHEMBL30162780 0.75 ALDH1A1 (0.46) MAPTMEN1KMT2ACYP2C9CYP2C19
SCHEMBL3863210 0.75 CA1 (0.49) SMN1; SMN2MAPTRAB9AMEN1KMT2A

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 SMN1; SMN2 3382/4885MAPT 1550/4885RAB9A 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.