SCHEMBL4352832

SCHEMBL4352832

CN(C)c1ccccc1C(N)=S

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.57
ALDH1A1 P00352 4/20 0.57
GAA P10253 4/20 0.57
SMN1; SMN2 Q16637 2/20 0.57
TSHR P16473 2/20 0.57
TP53 P04637 1/20 0.57
CHEK1 O14757 1/20 0.41
NEK2 P51955 1/20 0.41
LIMK1 P53667 1/20 0.41
DYRK1A Q13627 1/20 0.41
CLK4 Q9HAZ1 1/20 0.41
CNR2 P34972 2/20 0.40
KDM4E B2RXH2 1/20 0.37
EP300 Q09472 1/20 0.35
KAT2B Q92831 1/20 0.35
KAT8 Q9H7Z6 1/20 0.35
PKM P14618 1/20 0.34
HSD17B10 Q99714 1/20 0.34
HSP90AA1 P07900 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL15633355 0.80 MAPT (0.59) MAPTALDH1A1GAASMN1; SMN2TSHR
SCHEMBL147847 0.78 ALDH1A1 (0.69) MAPTALDH1A1GAASMN1; SMN2TSHR
SCHEMBL15632929 0.78 MAPT (0.57) MAPTALDH1A1GAASMN1; SMN2TSHR
SCHEMBL2491643 0.77 MAPT (0.67) MAPTALDH1A1GAASMN1; SMN2TSHR
SCHEMBL4308507 0.76 CHEK1 (0.53) MAPTALDH1A1GAASMN1; SMN2TSHR
SCHEMBL609919 0.75 ALDH1A1 (0.42) MAPTALDH1A1GAATSHRTP53
SCHEMBL5828459 0.75 ALDH1A1 (0.53) MAPTALDH1A1GAASMN1; SMN2TSHR
SCHEMBL1227388 0.73 MAPT (1.00) MAPTALDH1A1GAASMN1; SMN2TSHR
SCHEMBL29365484 0.73 MAPT (0.61) MAPTALDH1A1GAASMN1; SMN2TSHR
SCHEMBL12506468 0.73 MAPT (0.75) MAPTALDH1A1GAASMN1; SMN2TSHR

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104334629-B Rubber composition for tire tread and pneumatic tire 住友橡胶工业株式会社 2016-08-24 CN disclosed
CN-104334629-A Tread rubber composition and pneumatic tire SUMITOMO RUBBER IND 2015-02-04 CN disclosed
WO-2009120826-A1 2-ARYL- AND 2-HETEROARYLTHIAZOLYL COMPOUNDS, METHODS FOR THEIR PREPARATION AND USE THEREOF WYETH (US) 2009-10-01 WO disclosed