SCHEMBL972619

SCHEMBL972619

COC(=O)/C=C/c1cc(C=Cc2csc(NC(C)=O)n2)cs1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 4/20 0.47
KDM4E B2RXH2 3/20 0.47
MAPT P10636 1/20 0.47
ALDH1A1 P00352 4/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
KMT2A Q03164 2/20 0.39
MAPK1 P28482 2/20 0.39
MEN1 O00255 1/20 0.39
ALOX15 P16050 1/20 0.39
TYR P14679 1/20 0.39
NPC1 O15118 5/20 0.38
RAB9A P51151 4/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
HTT P42858 2/20 0.38
HPGD P15428 1/20 0.38
LMNA P02545 2/20 0.37
CASP3 P42574 1/20 0.37
SENP8 Q96LD8 1/20 0.37
SENP7 Q9BQF6 1/20 0.37
SENP6 Q9GZR1 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
SCHEMBL12947788 0.95 HSD17B10 (0.47) HSD17B10KDM4EMAPTALDH1A1L3MBTL1
SCHEMBL3403637 0.88 KDM4E (0.49) HSD17B10KDM4EMAPTALDH1A1L3MBTL1
SCHEMBL15158280 0.88 KDM4E (0.49) HSD17B10KDM4EMAPTALDH1A1L3MBTL1
SCHEMBL3403632 0.88 KDM4E (0.49) HSD17B10KDM4EMAPTALDH1A1L3MBTL1
SCHEMBL5550186 0.86 KDM4E (0.51) HSD17B10KDM4EMAPTALDH1A1L3MBTL1
SCHEMBL12919404 0.83 GRM5 (0.41) HSD17B10KDM4EMAPTALDH1A1KMT2A
SCHEMBL972009 0.82 HSD17B10 (0.52) HSD17B10KDM4EMAPTALDH1A1L3MBTL1
SCHEMBL972007 0.82 HSD17B10 (0.52) HSD17B10KDM4EMAPTALDH1A1L3MBTL1
SCHEMBL972620 0.81 KDM4E (0.52) HSD17B10KDM4EMAPTALDH1A1L3MBTL1
SCHEMBL972621 0.81 KDM4E (0.52) HSD17B10KDM4EMAPTALDH1A1L3MBTL1

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-8507690-B2 Thiazole derivative and use thereof as VAP-1 inhibitor R-TECH UENO, LTD. (JP) 2013-08-13 US disclosed
US-20110015240-A1 THIAZOLE DERIVATIVE AND USE THEREOF AS VAP-1 INHIBITOR R-TECH UENO, LTD. (JP) 2011-01-20 US disclosed
US-20110015240-A1 THIAZOLE DERIVATIVE AND USE THEREOF AS VAP-1 INHIBITOR R-TECH UENO, LTD. (JP) 2011-01-20 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-20110015240-A1 THIAZOLE DERIVATIVE AND USE THEREOF AS VAP-1 INHIBITOR VAPB, TAS1R1, VAPA HSD17B10 1468/4885KDM4E 3352/4885MAPT 858/4885

“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.