SCHEMBL8043947

SCHEMBL8043947

CS(=O)(=O)c1ccc2nc(Sc3nnc(-c4cccs4)n3-c3ccc(Oc4ccccc4)cc3)sc2c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.44
HSD17B10 Q99714 5/20 0.43
KDM4E B2RXH2 3/20 0.43
NPSR1 Q6W5P4 4/20 0.41
ALDH1A1 P00352 4/20 0.40
HPGD P15428 2/20 0.40
MAPK1 P28482 4/20 0.40
KMT2A Q03164 4/20 0.40
MEN1 O00255 3/20 0.40
MAPT P10636 2/20 0.40
PPARG P37231 2/20 0.40
RXFP1 Q9HBX9 2/20 0.40
NR2E3 Q9Y5X4 2/20 0.40
NCOR2 Q9Y618 2/20 0.40
GAA P10253 1/20 0.40
RECQL P46063 1/20 0.39
USP2 O75604 1/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
LMNA P02545 3/20 0.38
TP53 P04637 2/20 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
SCHEMBL8051920 0.93 TSHR (0.51) TSHRHSD17B10KDM4ENPSR1ALDH1A1
SCHEMBL8051866 0.92 NPSR1 (0.46) TSHRHSD17B10KDM4ENPSR1ALDH1A1
SCHEMBL8051273 0.88 TSHR (0.42) TSHRHSD17B10KDM4ENPSR1ALDH1A1
SCHEMBL8045522 0.88 PKM (0.44) TSHRHSD17B10KDM4ENPSR1ALDH1A1
SCHEMBL8048233 0.88 HSD17B10 (0.45) TSHRHSD17B10KDM4ENPSR1ALDH1A1
SCHEMBL8032457 0.87 TSHR (0.41) TSHRHSD17B10KDM4ENPSR1ALDH1A1
SCHEMBL8044199 0.87 TSHR (0.41) TSHRHSD17B10KDM4ENPSR1ALDH1A1
SCHEMBL8051251 0.85 PDK1 (0.43) TSHRHSD17B10KDM4ENPSR1ALDH1A1
SCHEMBL8033996 0.85 HSD17B10 (0.49) TSHRHSD17B10KDM4ENPSR1ALDH1A1
SCHEMBL8042648 0.85 NPSR1 (0.48) TSHRHSD17B10KDM4ENPSR1ALDH1A1

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