SCHEMBL525280

SCHEMBL525280

O=C(O)c1csc(Nc2ccc(Cl)cn2)n1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 6/20 0.56
KMT2A Q03164 6/20 0.56
MAPT P10636 5/20 0.56
SMN1; SMN2 Q16637 4/20 0.56
KDM4E B2RXH2 3/20 0.56
STAT3 P40763 1/20 0.56
NPC1 O15118 5/20 0.55
RAB9A P51151 5/20 0.55
NFKB1 P19838 2/20 0.54
NFKB2 Q00653 2/20 0.54
RELA Q04206 2/20 0.54
XBP1 P17861 1/20 0.54
AHR P35869 1/20 0.54
HTT P42858 1/20 0.54
NPSR1 Q6W5P4 1/20 0.54
SLC2A1 P11166 1/20 0.54
MAPK1 P28482 1/20 0.52
KDM1A O60341 3/20 0.50
LMNA P02545 2/20 0.50
TSHR P16473 2/20 0.50

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
SCHEMBL3028524 0.83 MEN1 (0.50) MEN1KMT2AMAPTSMN1; SMN2KDM4E
SCHEMBL14742760 0.83 RAB9A (0.60) MEN1KMT2AMAPTSMN1; SMN2KDM4E
SCHEMBL525388 0.81 EGFR (0.58) MEN1KMT2AMAPTSMN1; SMN2KDM4E
SCHEMBL525682 0.80 KDM1A (0.76) MEN1KMT2AMAPTSMN1; SMN2NPC1
SCHEMBL31661320 0.78 MEN1 (0.56) MEN1KMT2AMAPTSMN1; SMN2KDM4E
SCHEMBL525588 0.77 NPC1 (0.61) MEN1KMT2AMAPTSMN1; SMN2KDM4E
SCHEMBL5218680 0.77 KDM1A (0.56) MEN1KMT2AMAPTSMN1; SMN2NPC1
SCHEMBL20600045 0.75 SMN1; SMN2 (0.48) MEN1KMT2AMAPTSMN1; SMN2KDM4E
SCHEMBL525976 0.74 KDR (0.58) MEN1KMT2AMAPTSMN1; SMN2KDM4E
SCHEMBL3227030 0.74 KDM4E (0.50) MEN1KMT2ASMN1; SMN2KDM4ENPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8513430-B2 Substituted thiazol-2-ylamine derivatives, pharmaceutical compositions, and methods of use as 11-beta HSD1 modulators HIGH POINT PHARMACEUTICALS, LLC (US) 2013-08-20 US claimed
WO-2012015715-A1 SUBSTITUTED THIAZOL-2-YLAMINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF USE AS 11-BETA HSD1 MODULATORS HIGH POINT PHARMACEUTICALS, LLC (US) 2012-02-02 WO claimed
US-8513430-B2 Substituted thiazol-2-ylamine derivatives, pharmaceutical compositions, and methods of use as 11-beta HSD1 modulators HIGH POINT PHARMACEUTICALS, LLC (US) 2013-08-20 US disclosed
US-20120029029-A1 SUBSTITUTED THIAZOL-2-YLAMINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF USE AS 11-BETA HSD1 MODULATORS HIGH POINT PHARMACEUTICALS, LLC (US) 2012-02-02 US disclosed
WO-2012015715-A1 SUBSTITUTED THIAZOL-2-YLAMINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF USE AS 11-BETA HSD1 MODULATORS HIGH POINT PHARMACEUTICALS, LLC (US) 2012-02-02 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-20120029029-A1 SUBSTITUTED THIAZOL-2-YLAMINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF USE AS 11-BETA HSD1 MODULATORS HSD11B1, HSD11B2, HSD3B1 MEN1 1600/4885KMT2A 2653/4885MAPT 2385/4885

“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.