SCHEMBL2870272

SCHEMBL2870272

O=C(O)c1csc(Nc2cccc(Cl)c2)n1

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 2/20 0.78
MAPT P10636 8/20 0.67
GAA P10253 3/20 0.67
CSNK2A2 P19784 2/20 0.56
CSNK2B P67870 2/20 0.56
CSNK2A1 P68400 1/20 0.56
MEN1 O00255 7/20 0.55
KMT2A Q03164 7/20 0.55
ALDH1A1 P00352 3/20 0.55
SMN1; SMN2 Q16637 5/20 0.53
L3MBTL1 Q9Y468 2/20 0.53
KDM4E B2RXH2 2/20 0.53
HPGD P15428 2/20 0.53
CYP1A2 P05177 2/20 0.53
LMNA P02545 2/20 0.53
ATM Q13315 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
CYP1A1 P04798 1/20 0.53
CYP1B1 Q16678 1/20 0.53
CYP3A4 P08684 1/20 0.52

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
SCHEMBL29654005 0.89 KDM1A (0.78) KDM1AMAPTGAACSNK2A2CSNK2B
SCHEMBL28707161 0.89 KDM1A (0.78) KDM1AMAPTGAACSNK2A2CSNK2B
SCHEMBL2828892 0.84 MAPT (0.66) KDM1AMAPTGAACSNK2A2CSNK2B
SCHEMBL2285389 0.84 AMY1A (0.60) KDM1AMAPTGAACSNK2A1MEN1
SCHEMBL18342060 0.83 CSNK2A1 (0.56) KDM1AMAPTGAACSNK2A2CSNK2B
SCHEMBL28716317 0.83 KDM1A (0.70) KDM1AMAPTGAAMEN1KMT2A
SCHEMBL29654089 0.83 KDM1A (0.70) KDM1AMAPTGAAMEN1KMT2A
SCHEMBL525682 0.82 KDM1A (0.76) KDM1AMAPTGAACSNK2A2CSNK2B
SCHEMBL2880884 0.82 KDM1A (0.72) KDM1AMAPTGAAMEN1KMT2A
SCHEMBL525319 0.82 KDM1A (0.55) KDM1AMAPTGAACSNK2A2CSNK2B

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
WO-2010012793-A1 FUNGICIDE AMINOTHIAZOLE DERIVATIVES BAYER CROPSCIENCE SA (FR) 2010-02-04 WO disclosed
WO-2010012793-A1 FUNGICIDE AMINOTHIAZOLE DERIVATIVES BAYER CROPSCIENCE SA (FR) 2010-02-04 WO disclosed