SCHEMBL8051273

SCHEMBL8051273

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

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 6/20 0.42
HSD17B10 Q99714 5/20 0.41
KDM4E B2RXH2 2/20 0.41
SMN1; SMN2 Q16637 5/20 0.40
KMT2A Q03164 3/20 0.40
RAB9A P51151 3/20 0.40
MEN1 O00255 2/20 0.40
LMNA P02545 2/20 0.40
TP53 P04637 2/20 0.40
NPC1 O15118 2/20 0.40
PKM P14618 2/20 0.40
PTGS2 P35354 1/20 0.39
CSNK1D P48730 1/20 0.38
HTT P42858 2/20 0.38
MAPT P10636 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
ALDH1A1 P00352 3/20 0.38
MAPK1 P28482 1/20 0.38
RECQL P46063 1/20 0.37
SCD O00767 1/20 0.37

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 0.92 TSHR (0.51) TSHRHSD17B10KDM4ESMN1; SMN2KMT2A
SCHEMBL8045522 0.91 PKM (0.44) TSHRHSD17B10KDM4ESMN1; SMN2KMT2A
SCHEMBL8051866 0.90 NPSR1 (0.46) TSHRHSD17B10KDM4ESMN1; SMN2KMT2A
SCHEMBL8044199 0.90 TSHR (0.41) TSHRHSD17B10KDM4ESMN1; SMN2KMT2A
SCHEMBL8032457 0.90 TSHR (0.41) TSHRHSD17B10KDM4ESMN1; SMN2KMT2A
SCHEMBL8048233 0.89 HSD17B10 (0.45) TSHRHSD17B10KDM4ESMN1; SMN2KMT2A
SCHEMBL8043947 0.88 TSHR (0.44) TSHRHSD17B10KDM4ESMN1; SMN2KMT2A
SCHEMBL8044959 0.86 TSHR (0.45) TSHRHSD17B10KDM4ESMN1; SMN2KMT2A
SCHEMBL8044955 0.85 USP2 (0.48) TSHRHSD17B10KDM4ESMN1; SMN2KMT2A
SCHEMBL8042744 0.84 PDK1 (0.46) TSHRHSD17B10KDM4ESMN1; SMN2KMT2A

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