SCHEMBL8049900

SCHEMBL8049900

CCOC(=O)Cc1ccc(C2=NC(=S)N=N2)[nH]1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.41
KMT2A Q03164 2/20 0.39
TDP1 Q9NUW8 1/20 0.39
HSD17B10 Q99714 2/20 0.38
CHEK1 O14757 1/20 0.35
MAPK1 P28482 2/20 0.34
ALDH1A1 P00352 1/20 0.34
USP2 O75604 1/20 0.34
TSHR P16473 1/20 0.34
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34
LMNA P02545 2/20 0.34
L3MBTL1 Q9Y468 3/20 0.33
GAA P10253 2/20 0.33
PKM P14618 2/20 0.33
MEN1 O00255 1/20 0.33
MAPT P10636 1/20 0.33
RECQL P46063 1/20 0.33

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
SCHEMBL8043885 0.76 KMT2A (0.40) SMN1; SMN2KMT2ATDP1HSD17B10ALDH1A1
SCHEMBL8044768 0.75 KMT2A (0.45) SMN1; SMN2KMT2ATDP1HSD17B10CHEK1
SCHEMBL8051645 0.72 SMN1; SMN2 (0.43) SMN1; SMN2KMT2ATDP1HSD17B10ALDH1A1
SCHEMBL8050345 0.71 KMT2A (0.38) SMN1; SMN2KMT2ATDP1MAPK1ALDH1A1
SCHEMBL8050555 0.68 RPS6KB2 (0.39) SMN1; SMN2KMT2AMAPK1ALDH1A1TSHR
SCHEMBL4558567 0.66 SMN1; SMN2 (0.49) SMN1; SMN2KMT2ATDP1HSD17B10CHEK1
SCHEMBL4017941 0.66 SMN1; SMN2 (0.49) SMN1; SMN2KMT2ATDP1HSD17B10CHEK1
SCHEMBL4564379 0.65 SMN1; SMN2 (0.48) SMN1; SMN2HSD17B10ALDH1A1MAPT
SCHEMBL4012449 0.64 PKM (0.49) SMN1; SMN2KMT2ATDP1HSD17B10CHEK1
SCHEMBL4018484 0.64 PKM (0.49) SMN1; SMN2KMT2ATDP1HSD17B10CHEK1

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-6080772-A 2-AMINOTHIAZOLE TRIAZOLE OR TETRAZOLE COMPOUND FOR REGULATING PROTEIN TYROSINE PHOSPHATASE ACTIVITY SUGEN, INC. (US) 2000-06-27 US disclosed
WO-1998027092-A1 THIAZOLE COMPOUNDS AND METHODS OF MODULATING SIGNAL TRANSDUCTION SUGEN, INC. (US) 1998-06-25 WO disclosed