SCHEMBL5126971

SCHEMBL5126971

CCOC(=O)c1csc(Cc2cc(Cl)ccc2OCc2ccc(F)cc2)n1

nearest known ligand 0.62

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 11/20 0.62
MAPT P10636 3/20 0.55
NPC1 O15118 2/20 0.55
RAB9A P51151 2/20 0.55
MMP13 P45452 4/20 0.54
MMP1 P03956 1/20 0.49
ANO1 Q5XXA6 1/20 0.47
LMNA P02545 1/20 0.47
MAPK1 P28482 1/20 0.47
HSP90AA1 P07900 1/20 0.45
ALDH1A1 P00352 1/20 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
SCHEMBL5120560 0.94 PTGER1 (0.66) PTGER1MAPTNPC1RAB9AMMP13
SCHEMBL4722380 0.91 PTGER1 (0.75) PTGER1MAPTNPC1RAB9AMMP13
SCHEMBL5123536 0.90 PTGER1 (0.58) PTGER1MAPTNPC1RAB9AMMP13
SCHEMBL5117578 0.89 PTGER1 (0.58) PTGER1MAPTNPC1RAB9AANO1
SCHEMBL5117485 0.89 PTGER1 (0.58) PTGER1MAPTNPC1RAB9AANO1
SCHEMBL5125098 0.89 MMP13 (0.54) PTGER1MAPTNPC1RAB9AMMP13
SCHEMBL5130282 0.88 PTGER1 (0.57) PTGER1MAPTNPC1RAB9AANO1
SCHEMBL5121388 0.88 PTGER1 (0.70) PTGER1MMP13MMP1
SCHEMBL5126958 0.87 MMP13 (0.53) PTGER1MAPTNPC1RAB9AMMP13
SCHEMBL5119554 0.87 PTGER1 (0.57) PTGER1MAPTNPC1RAB9AMMP13

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080207708-A1 Oxazole and Thiazole Compounds and Their Use in the Treatment of Pge2 Mediated Disorders GLAXO GROUP LIMITED (GB) 2008-08-28 US disclosed
US-20080207708-A1 Oxazole and Thiazole Compounds and Their Use in the Treatment of Pge2 Mediated Disorders GLAXO GROUP LIMITED (GB) 2008-08-28 US disclosed
US-20080207708-A1 Oxazole and Thiazole Compounds and Their Use in the Treatment of Pge2 Mediated Disorders GLAXO GROUP LIMITED (GB) 2008-08-28 US 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-20080207708-A1 Oxazole and Thiazole Compounds and Their Use in the Treatment of Pge2 Mediated Disorders PTGER1, PTGER2, PTGER4 PTGER1 1/4885MAPT 4703/4885NPC1 3020/4885

“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.