SCHEMBL4079438

SCHEMBL4079438

O=C1OCCN1c1nc(-c2ccc(Br)cc2)cs1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 10/20 0.60
SMN1; SMN2 Q16637 9/20 0.60
NPC1 O15118 8/20 0.60
MAPT P10636 7/20 0.60
MEN1 O00255 6/20 0.60
KMT2A Q03164 6/20 0.60
LMNA P02545 2/20 0.60
MAPK1 P28482 2/20 0.60
CA1 P00915 1/20 0.56
CYP1A2 P05177 2/20 0.48
CYP2C9 P11712 2/20 0.48
CYP2C19 P33261 2/20 0.48
ALDH1A1 P00352 2/20 0.48
CYP2D6 P10635 1/20 0.48
HPGD P15428 1/20 0.46
TSHR P16473 1/20 0.44
POLB P06746 1/20 0.44
ESR1 P03372 1/20 0.44
HTT P42858 1/20 0.44
AR P10275 3/20 0.44

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
SCHEMBL3863110 0.92 RAB9A (0.57) RAB9ASMN1; SMN2NPC1MAPTMEN1
SCHEMBL4083245 0.87 NPC1 (0.60) RAB9ASMN1; SMN2NPC1MAPTMEN1
SCHEMBL4078466 0.84 AR (0.55) RAB9ASMN1; SMN2NPC1MAPTMEN1
SCHEMBL3863210 0.80 CA1 (0.49) RAB9ASMN1; SMN2NPC1MAPTMEN1
SCHEMBL4087304 0.80 AR (0.51) RAB9ASMN1; SMN2NPC1MAPTMEN1
SCHEMBL3527455 0.77 SMN1; SMN2 (0.57) RAB9ASMN1; SMN2NPC1MAPTMEN1
SCHEMBL3524975 0.76 SMN1; SMN2 (0.56) RAB9ASMN1; SMN2NPC1MAPTMEN1
SCHEMBL4075394 0.76 SMN1; SMN2 (0.53) RAB9ASMN1; SMN2NPC1MAPTMEN1
SCHEMBL2560440 0.75 RAB9A (1.00) RAB9ASMN1; SMN2NPC1MAPTMEN1
SCHEMBL23810259 0.75 AR (0.37) RAB9ASMN1; SMN2NPC1MAPTMEN1

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 RAB9A 1677/4885SMN1; SMN2 3382/4885NPC1 4830/4885

“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.