SCHEMBL8043746

SCHEMBL8043746

Cc1csc(Sc2nnnn2CC(=O)O)n1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.43
RAB9A P51151 3/20 0.43
ALDH1A1 P00352 3/20 0.40
HPGD P15428 2/20 0.40
LMNA P02545 2/20 0.40
KMT2A Q03164 4/20 0.39
NPC1 O15118 2/20 0.39
MEN1 O00255 3/20 0.37
THRB P10828 1/20 0.37
GLA P06280 1/20 0.36
MAPT P10636 1/20 0.36
MAPK1 P28482 1/20 0.36
POLB P06746 1/20 0.36
GAA P10253 1/20 0.36
USP2 O75604 1/20 0.36
TP53 P04637 1/20 0.36
HSD17B10 Q99714 1/20 0.36
PKM P14618 1/20 0.36

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
SCHEMBL8051238 0.83 HSD17B10 (0.42) SMN1; SMN2RAB9AALDH1A1HPGDLMNA
SCHEMBL8032361 0.82 ALDH1A1 (0.47) SMN1; SMN2RAB9AALDH1A1LMNAKMT2A
SCHEMBL8048335 0.80 RAB9A (0.45) SMN1; SMN2RAB9AALDH1A1HPGDLMNA
SCHEMBL8044019 0.80 KMT2A (0.40) SMN1; SMN2RAB9AALDH1A1LMNAKMT2A
SCHEMBL8047351 0.78 KMT2A (0.47) RAB9AALDH1A1HPGDLMNAKMT2A
SCHEMBL8044036 0.77 KMT2A (0.44) SMN1; SMN2RAB9AALDH1A1HPGDLMNA
SCHEMBL8042823 0.77 ALDH1A1 (0.44) SMN1; SMN2RAB9AALDH1A1HPGDLMNA
SCHEMBL8046169 0.77 KDM4C (0.39) SMN1; SMN2RAB9AALDH1A1HPGDLMNA
SCHEMBL8033559 0.76 LMNA (0.47) RAB9AALDH1A1LMNAKMT2ANPC1
SCHEMBL8048771 0.75 MAPT (0.37) ALDH1A1HPGDLMNAKMT2ANPC1

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