SCHEMBL8034357

SCHEMBL8034357

c1ccc(Oc2ccc(-n3c(Sc4nc(-c5ccccc5)cs4)nnc3-c3cccs3)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 8/20 0.50
HSD17B10 Q99714 8/20 0.50
KDM4E B2RXH2 4/20 0.50
ALDH1A1 P00352 4/20 0.47
MAPK1 P28482 3/20 0.47
NPSR1 Q6W5P4 5/20 0.44
HPGD P15428 3/20 0.43
MEN1 O00255 2/20 0.42
PPARG P37231 2/20 0.42
KMT2A Q03164 2/20 0.42
RXFP1 Q9HBX9 2/20 0.42
NR2E3 Q9Y5X4 2/20 0.42
NCOR2 Q9Y618 2/20 0.42
MAPT P10636 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42
RECQL P46063 1/20 0.42
HTT P42858 1/20 0.41
CYP1A2 P05177 1/20 0.41

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
SCHEMBL8033884 0.93 KDM4E (0.50) TSHRHSD17B10KDM4EALDH1A1MAPK1
SCHEMBL8041786 0.91 NPSR1 (0.55) TSHRHSD17B10KDM4EALDH1A1MAPK1
SCHEMBL8049124 0.91 TSHR (0.60) TSHRHSD17B10KDM4EALDH1A1MAPK1
SCHEMBL8042871 0.89 TSHR (0.44) TSHRHSD17B10KDM4EALDH1A1MAPK1
SCHEMBL8042464 0.88 TSHR (0.52) TSHRHSD17B10KDM4EALDH1A1MAPK1
SCHEMBL8044256 0.88 TSHR (0.55) TSHRHSD17B10KDM4EALDH1A1MAPK1
SCHEMBL8046090 0.85 TSHR (0.52) TSHRHSD17B10KDM4EALDH1A1MAPK1
SCHEMBL8046331 0.85 TSHR (0.52) TSHRHSD17B10KDM4EALDH1A1MAPK1
SCHEMBL8050703 0.85 HSD17B10 (0.49) TSHRHSD17B10KDM4EALDH1A1MAPK1
SCHEMBL8051082 0.84 TSHR (0.55) TSHRHSD17B10KDM4EALDH1A1MAPK1

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