SCHEMBL8046372

SCHEMBL8046372

CS(=O)(=O)c1ccc2nc(Sc3nnc(-c4cccs4)n3CCc3ccccc3)sc2c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.41
NPC1 O15118 3/20 0.41
ALDH1A1 P00352 4/20 0.41
KMT2A Q03164 4/20 0.41
HSD17B10 Q99714 3/20 0.41
USP2 O75604 3/20 0.41
MEN1 O00255 3/20 0.41
LMNA P02545 5/20 0.41
HTT P42858 4/20 0.41
TSHR P16473 4/20 0.41
SMN1; SMN2 Q16637 5/20 0.41
MAPT P10636 3/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
GALR3 O60755 1/20 0.40
POLB P06746 1/20 0.40
ESR2 Q92731 1/20 0.40
CTDSP1 Q9GZU7 1/20 0.40
HPGD P15428 1/20 0.40
CSNK1D P48730 1/20 0.40
TP53 P04637 2/20 0.39

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
SCHEMBL8042112 0.86 CSNK1D (0.39) RAB9ANPC1ALDH1A1KMT2AHSD17B10
SCHEMBL8044044 0.86 KMT2A (0.45) RAB9ANPC1ALDH1A1KMT2AHSD17B10
SCHEMBL8044738 0.86 CSNK1D (0.39) RAB9ANPC1ALDH1A1KMT2AHSD17B10
SCHEMBL8044955 0.86 USP2 (0.48) RAB9ANPC1ALDH1A1KMT2AHSD17B10
SCHEMBL8050255 0.85 MAPT (0.46) RAB9ANPC1ALDH1A1KMT2AHSD17B10
SCHEMBL8043994 0.85 ALDH1A1 (0.53) RAB9ANPC1ALDH1A1KMT2AHSD17B10
SCHEMBL8048043 0.84 CPB1 (0.43) RAB9ANPC1ALDH1A1KMT2AHSD17B10
SCHEMBL8051920 0.84 TSHR (0.51) RAB9ANPC1ALDH1A1KMT2AHSD17B10
SCHEMBL8046376 0.81 SMN1; SMN2 (0.41) RAB9ANPC1ALDH1A1KMT2AHSD17B10
SCHEMBL8043947 0.79 TSHR (0.44) RAB9ANPC1ALDH1A1KMT2AHSD17B10

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