SCHEMBL5116002

SCHEMBL5116002

CCOC(=O)c1csc(Cc2cc(C(F)(F)F)ccc2OCc2cccc(F)c2F)n1

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 6/20 0.53
MAPT P10636 4/20 0.46
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
HSP90AA1 P07900 1/20 0.42
PTGER1 P34995 4/20 0.41
MMP13 P45452 3/20 0.40
GUCY1B2 O75343 1/20 0.39
GUCY1A2 P33402 1/20 0.39
GUCY1A1 Q02108 1/20 0.39
GUCY1B1 Q02153 1/20 0.39
MMP1 P03956 1/20 0.39
TPH1 P17752 1/20 0.38
ALDH1A1 P00352 1/20 0.38
GAA P10253 1/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL5120632 0.93 MAPT (0.50) MRGPRX4MAPTNPC1RAB9AHSP90AA1
SCHEMBL5125052 0.93 MRGPRX4 (0.48) MRGPRX4MAPTNPC1RAB9AHSP90AA1
SCHEMBL5128854 0.89 MAPT (0.46) MRGPRX4MAPTNPC1RAB9AHSP90AA1
SCHEMBL5117392 0.88 PTGER1 (0.54) MRGPRX4PTGER1
SCHEMBL5130507 0.87 MAPT (0.47) MRGPRX4MAPTNPC1RAB9AHSP90AA1
SCHEMBL5124847 0.87 MAPT (0.59) MRGPRX4MAPTNPC1RAB9AHSP90AA1
SCHEMBL5130014 0.87 MAPT (0.49) MRGPRX4MAPTNPC1RAB9AHSP90AA1
SCHEMBL4723594 0.86 PTGER1 (0.56) MRGPRX4MAPTNPC1RAB9AHSP90AA1
SCHEMBL5125557 0.86 PTGER1 (0.48) MRGPRX4MAPTNPC1RAB9APTGER1
SCHEMBL5126958 0.85 MMP13 (0.53) MRGPRX4MAPTNPC1RAB9AHSP90AA1

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 2 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

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 MRGPRX4 185/4885MAPT 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.