SCHEMBL6866526

SCHEMBL6866526

Nc1nc2[nH]c(SCCOc3ccccc3)nc(=O)c2s1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.58
GAA P10253 1/20 0.58
MAOB P27338 1/20 0.53
AR P10275 5/20 0.50
TP53 P04637 2/20 0.50
NPC1 O15118 2/20 0.50
LMNA P02545 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
ALDH1A1 P00352 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
NPSR1 Q6W5P4 2/20 0.46
TSHR P16473 1/20 0.46
RXFP1 Q9HBX9 1/20 0.46
MAPT P10636 1/20 0.45
RAB9A P51151 1/20 0.44
CXCR2 P25025 2/20 0.43
THRB P10828 1/20 0.43

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
SCHEMBL841338 0.80 CXCR2 (0.66) MAOBNPC1LMNASMN1; SMN2ALDH1A1
SCHEMBL6866754 0.78 CXCR2 (0.72) MAOBTP53NPC1LMNASMN1; SMN2
SCHEMBL6866145 0.77 MEN1 (0.49) NPC1SMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL6866758 0.74 MEN1 (0.57) GAANPC1LMNASMN1; SMN2MEN1
SCHEMBL6859486 0.71 HTT (0.40) KDM4EGAATP53NPC1LMNA
SCHEMBL6868931 0.71 CXCR2 (0.47) KDM4ETP53LMNAMEN1KMT2A
SCHEMBL6868838 0.70 CTSB (0.52) NPC1LMNASMN1; SMN2MEN1KMT2A
SCHEMBL6864187 0.70 KMT2A (0.60) MAOBLMNAMEN1KMT2AL3MBTL1
SCHEMBL6865630 0.70 CXCR2 (0.47) GAALMNASMN1; SMN2MEN1KMT2A
SCHEMBL6866524 0.68 L3MBTL1 (0.43) KDM4EGAAMAOBARTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6806273-B1 5-THIO-THIAZOLO(4,5-D)PYRIMIDIN-7-YL DERIVATIVES; CHEMOKINE RECEPTOR (ESPECIALLY CXCR2) ACTIVITY MODULATORS ASTRAZENECA AB (SE) 2004-10-19 US claimed
EP-1104425-B1 NOVEL THIAZOLOPYRIMIDINE COMPOUNDS ASTRAZENECA AB (SE) 2003-01-29 EP claimed
EP-1104425-A1 NOVEL THIAZOLOPYRIMIDINE COMPOUNDS AstraZeneca AB (SE) 2001-06-06 EP claimed
WO-2000009511-A1 NOVEL THIAZOLOPYRIMIDINE COMPOUNDS ASTRAZENECA AB (SE) 2000-02-24 WO claimed
US-6806273-B1 5-THIO-THIAZOLO(4,5-D)PYRIMIDIN-7-YL DERIVATIVES; CHEMOKINE RECEPTOR (ESPECIALLY CXCR2) ACTIVITY MODULATORS ASTRAZENECA AB (SE) 2004-10-19 US disclosed
EP-1104425-B1 NOVEL THIAZOLOPYRIMIDINE COMPOUNDS ASTRAZENECA AB (SE) 2003-01-29 EP disclosed