SCHEMBL8042833

SCHEMBL8042833

COCCCn1c(Sc2nc3c(Cl)cccc3s2)nnc1-c1cccs1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.48
TSHR P16473 4/20 0.48
MEN1 O00255 4/20 0.48
HSP90AA1 P07900 1/20 0.46
HSP90AB1 P08238 1/20 0.46
KDM4E B2RXH2 5/20 0.44
GAA P10253 4/20 0.44
HTT P42858 2/20 0.44
GLA P06280 2/20 0.44
HPGD P15428 4/20 0.42
LMNA P02545 3/20 0.42
RAB9A P51151 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
NPC1 O15118 1/20 0.41
USP2 O75604 2/20 0.39
ALDH1A1 P00352 2/20 0.39
HSD17B10 Q99714 2/20 0.39
MAPT P10636 6/20 0.39
NPSR1 Q6W5P4 1/20 0.39
L3MBTL1 Q9Y468 1/20 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
SCHEMBL8050831 0.87 HSP90AA1 (0.46) KMT2ATSHRMEN1HSP90AA1HSP90AB1
SCHEMBL8047245 0.85 KDM4E (0.54) KMT2ATSHRMEN1HSP90AA1HSP90AB1
SCHEMBL8043169 0.84 HSP90AA1 (0.46) KMT2ATSHRMEN1HSP90AA1HSP90AB1
SCHEMBL8042284 0.83 TSHR (0.56) KMT2ATSHRMEN1HSP90AA1HSP90AB1
SCHEMBL8048024 0.83 TSHR (0.43) KMT2ATSHRMEN1HSP90AA1HSP90AB1
SCHEMBL8046525 0.80 TSHR (0.49) KMT2ATSHRMEN1KDM4EGAA
SCHEMBL8032454 0.80 TSHR (0.49) KMT2ATSHRMEN1KDM4EGAA
SCHEMBL8043590 0.80 KDM4E (0.53) KMT2ATSHRMEN1KDM4EGAA
SCHEMBL8047456 0.79 MEN1 (0.47) KMT2ATSHRMEN1KDM4EGAA
SCHEMBL8047465 0.78 NPSR1 (0.47) KMT2ATSHRMEN1HSP90AA1HSP90AB1

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