SCHEMBL4867323

SCHEMBL4867323

COC(=O)c1ccc(C(=O)C(Br)c2ccc(SC)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.50
MAPT P10636 4/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
GAA P10253 3/20 0.50
HTT P42858 2/20 0.50
ALDH1A1 P00352 2/20 0.50
ALOX15 P16050 1/20 0.50
PLK1 P53350 1/20 0.42
CA1 P00915 2/20 0.42
CA2 P00918 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
CA12 O43570 1/20 0.42
CA7 P43166 1/20 0.42
CA9 Q16790 1/20 0.42
CA14 Q9ULX7 1/20 0.42
KDM4E B2RXH2 3/20 0.41
RAB9A P51151 2/20 0.41
NPC1 O15118 1/20 0.41
HSD17B10 Q99714 1/20 0.41
MEN1 O00255 2/20 0.40

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
SCHEMBL5265061 0.85 CYP1A2 (0.51) MAPTSMN1; SMN2ALDH1A1CA1CA2
SCHEMBL4988038 0.83 PLK1 (0.42) TSHRSMN1; SMN2HTTALDH1A1PLK1
SCHEMBL7833587 0.83 PLK1 (0.42) TSHRMAPTSMN1; SMN2GAAALDH1A1
SCHEMBL7843096 0.83 PLK1 (0.42) SMN1; SMN2ALDH1A1PLK1CA1CA2
SCHEMBL6516239 0.83 PLK1 (0.42) SMN1; SMN2ALDH1A1PLK1CA1CA2
SCHEMBL749776 0.82 MAPT (0.66) TSHRMAPTSMN1; SMN2GAAHTT
SCHEMBL7089429 0.82 PLK1 (0.41) MAPTSMN1; SMN2HTTALDH1A1PLK1
SCHEMBL7508723 0.82 PLK1 (0.41) MAPTSMN1; SMN2HTTALDH1A1PLK1
SCHEMBL7843939 0.82 AKR1C3 (0.48) TSHRMAPTSMN1; SMN2ALDH1A1ALOX15
SCHEMBL7845030 0.81 AKR1C3 (0.46) MAPTSMN1; SMN2ALDH1A1PLK1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1608365-B1 METHOD FOR TREATING VASCULAR HYPERPERMEABLE DISEASE R TECH UENO LTD (JP) 2013-10-02 EP disclosed
US-7442715-B2 Thiazole derivatives ASTELLAS PHARMA INC. (JP) 2008-10-28 US disclosed
US-20060276521-A1 Thiazole derivatives ASTELLAS PHARMA INC. (JP) 2006-12-07 US disclosed
US-7125901-B2 Thiazole derivatives ASTELLAS PHARMA INC. (JP) 2006-10-24 US disclosed
US-20060229346-A1 Method for treating vascular hyperpermeable disease SUCAMPO AG (CH) 2006-10-12 US disclosed
US-20060128770-A1 Thiazole derivatives FUJISAWA PHARMACEUTICAL CO. LTD. (JP) 2006-06-15 US disclosed
EP-1608365-A1 METHOD FOR TREATING VASCULAR HYPERPERMEABLE DISEASE Sucampo AG (CH) 2005-12-28 EP disclosed
US-20040259923-A1 Compound useful as cellular adhesion protein and as antiedemic agent FUJISAWA PHARMACEUTICAL CO. LTD. (JP) 2004-12-23 US disclosed
WO-2004087138-A1 METHOD FOR TREATING VASCULAR HYPERPERMEABLE DISEASE SUCAMPO AG (CH) 2004-10-14 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 (4 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-20060276521-A1 Thiazole derivatives VCAM1, ICAM1, TXNL1 TSHR 501/4885MAPT 320/4885SMN1; SMN2 966/4885
US-20060229346-A1 Method for treating vascular hyperpermeable disease VCAM1, VAPB, ICAM1 TSHR 2931/4885MAPT 670/4885SMN1; SMN2 3587/4885
US-20060128770-A1 Thiazole derivatives VCAM1, ICAM1, TXNL1 TSHR 501/4885MAPT 320/4885SMN1; SMN2 966/4885
US-20040259923-A1 Compound useful as cellular adhesion protein and as antiedemic agent VCAM1, ICAM1, VAPB TSHR 3848/4885MAPT 1121/4885SMN1; SMN2 1570/4885

“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.