SCHEMBL8042791

SCHEMBL8042791

Cc1[nH]c(-c2nnc(Sc3nc(-c4ccc(Cl)cc4)cs3)n2-c2ccccc2)c(C)c1C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 2/20 0.39
LMNA P02545 6/20 0.38
TSHR P16473 3/20 0.38
NPSR1 Q6W5P4 2/20 0.38
HTT P42858 3/20 0.37
MAPT P10636 2/20 0.37
GAA P10253 1/20 0.37
AR P10275 1/20 0.36
USP2 O75604 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
ALOX5 P09917 1/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
ALDH1A1 P00352 2/20 0.35
IDH1 O75874 1/20 0.35
TERT O14746 1/20 0.35
CDC25A P30304 1/20 0.35
CDC25B P30305 1/20 0.35
HPGD P15428 1/20 0.35
METAP2 P50579 1/20 0.35

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
SCHEMBL8043948 0.93 ALDH1A1 (0.39) LMNATSHRHTTMAPTUSP2
SCHEMBL8051017 0.84 ALDH1A1 (0.41) LMNATSHRNPSR1MAPTGAA
SCHEMBL8051011 0.83 EIF4E (0.35) TSHRMAPTGAASMN1; SMN2MEN1
SCHEMBL8050081 0.80 TSHR (0.48) SIRT2LMNATSHRNPSR1HTT
SCHEMBL8051082 0.80 TSHR (0.55) LMNATSHRNPSR1HTTMAPT
SCHEMBL8716316 0.80 TP53 (0.54) SIRT2LMNATSHRNPSR1HTT
SCHEMBL8052083 0.78 ALDH1A1 (0.47) SIRT2LMNATSHRNPSR1HTT
SCHEMBL8051083 0.78 ALOX5 (0.39) SIRT2LMNAHTTMAPTGAA
SCHEMBL8050649 0.77 RECQL (0.37) TSHRMAPTGAAMEN1KMT2A
SCHEMBL8042745 0.77 RPA1 (0.47) SIRT2LMNATSHRNPSR1HTT

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