SCHEMBL8033935

SCHEMBL8033935

c1cncc(-n2nnnc2Sc2nccs2)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 4/20 0.47
POLB P06746 4/20 0.42
TDP1 Q9NUW8 2/20 0.41
ALDH1A1 P00352 7/20 0.41
LMNA P02545 4/20 0.41
HTT P42858 4/20 0.41
KMT2A Q03164 3/20 0.41
MAPT P10636 3/20 0.41
TP53 P04637 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
MAPK1 P28482 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
GAA P10253 2/20 0.41
MEN1 O00255 2/20 0.40
CYP2A6 P11509 1/20 0.39
JAK2 O60674 1/20 0.39
TLR9 Q9NR96 1/20 0.39
HPGD P15428 2/20 0.38
TSHR P16473 1/20 0.38
HSD11B1 P28845 1/20 0.38

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
SCHEMBL8032540 0.87 ALDH1A1 (0.53) HSD17B10POLBTDP1ALDH1A1LMNA
SCHEMBL8043953 0.80 TDP1 (0.47) HSD17B10POLBTDP1ALDH1A1LMNA
SCHEMBL8045990 0.80 ALDH1A1 (0.42) HSD17B10POLBTDP1ALDH1A1LMNA
SCHEMBL8032781 0.79 TP53 (0.46) HSD17B10TDP1ALDH1A1LMNAHTT
SCHEMBL8043807 0.77 HSD17B10 (0.36) HSD17B10TDP1ALDH1A1LMNAHTT
SCHEMBL8044443 0.77 ALDH1A1 (0.49) HSD17B10POLBTDP1ALDH1A1LMNA
SCHEMBL8043896 0.77 SMN1; SMN2 (0.43) HSD17B10POLBALDH1A1LMNAHTT
SCHEMBL8042445 0.77 HSD17B10 (0.44) HSD17B10POLBALDH1A1LMNAHTT
SCHEMBL8041912 0.77 SMN1; SMN2 (0.47) HSD17B10TDP1ALDH1A1LMNAHTT
SCHEMBL8044064 0.77 ALDH1A1 (0.41) HSD17B10POLBTDP1ALDH1A1LMNA

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