SCHEMBL8033836

SCHEMBL8033836

COCCCn1c(Sc2nc(-c3ccc(Cl)cc3)cs2)nnc1-c1cccs1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.47
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
MAPT P10636 5/20 0.45
LMNA P02545 4/20 0.45
TP53 P04637 1/20 0.45
POLB P06746 1/20 0.45
KDM4E B2RXH2 5/20 0.45
GAA P10253 3/20 0.45
HTT P42858 3/20 0.45
GLA P06280 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.40
PLA2G1B P04054 1/20 0.40
RAB9A P51151 1/20 0.40
ATG4B Q9Y4P1 1/20 0.40
APOBEC3G Q9HC16 1/20 0.39
HPGD P15428 2/20 0.39
NPSR1 Q6W5P4 2/20 0.38
HSD17B10 Q99714 1/20 0.38
MIF P14174 1/20 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
SCHEMBL8043767 0.92 KDM4E (0.49) TSHRMEN1KMT2AMAPTLMNA
SCHEMBL8033660 0.87 MAPT (0.44) TSHRMEN1KMT2AMAPTLMNA
SCHEMBL8045082 0.85 MEN1 (0.45) TSHRMEN1KMT2AMAPTLMNA
SCHEMBL8043590 0.84 KDM4E (0.53) TSHRMEN1KMT2AMAPTLMNA
SCHEMBL8050349 0.84 MAPT (0.42) TSHRMEN1KMT2AMAPTLMNA
SCHEMBL8048096 0.83 MAPT (0.55) TSHRMEN1KMT2AMAPTLMNA
SCHEMBL8033974 0.83 LMNA (0.49) TSHRMEN1KMT2AMAPTLMNA
SCHEMBL8032454 0.79 TSHR (0.49) TSHRMEN1KMT2AMAPTLMNA
SCHEMBL8045928 0.78 TSHR (0.52) TSHRMEN1KMT2AMAPTLMNA
SCHEMBL8050800 0.78 HTR1A (0.49) TSHRKMT2AMAPTLMNAPOLB

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