SCHEMBL12643259

SCHEMBL12643259

N#Cc1c(N)sc2c1CCC1=NNCC12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BPTF Q12830 3/20 0.39
ALDH1A1 P00352 7/20 0.38
MAPT P10636 6/20 0.38
GAA P10253 5/20 0.38
HSD17B10 Q99714 3/20 0.38
ALOX15 P16050 2/20 0.38
MAPK1 P28482 2/20 0.38
MEN1 O00255 5/20 0.37
KMT2A Q03164 5/20 0.37
POLB P06746 2/20 0.37
CASP1 P29466 2/20 0.37
PABPC1 P11940 1/20 0.37
KDM4E B2RXH2 4/20 0.36
HPGD P15428 3/20 0.36
RECQL P46063 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
GLA P06280 1/20 0.32
TAAR1 Q96RJ0 1/20 0.32
CASP7 P55210 1/20 0.32

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
SCHEMBL12643399 0.69 BPTF (0.37) BPTFALDH1A1MAPTGAAHSD17B10
SCHEMBL12643317 0.65 ADORA1 (0.38) BPTFALDH1A1MAPTGAAHSD17B10
SCHEMBL12643489 0.65 PLAUR (0.34) BPTFALDH1A1MAPTGAAHSD17B10
SCHEMBL12643506 0.64
SCHEMBL2648424 0.63 BPTF (0.44) BPTFALDH1A1MAPTGAAHSD17B10
SCHEMBL12643261 0.63 BPTF (0.43) BPTFALDH1A1MAPTGAAHSD17B10
SCHEMBL12643575 0.60 ALDH1A1 (0.42) BPTFALDH1A1MAPTGAAHSD17B10
SCHEMBL5897153 0.58 ALDH1A1 (0.40) BPTFALDH1A1MAPTGAAHSD17B10
SCHEMBL1514467 0.57 BPTF (0.92) BPTFALDH1A1MAPTGAAHSD17B10
SCHEMBL620749 0.57 BPTF (1.00) BPTFALDH1A1MAPTGAAHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011077502-A1 DIHYDROTHIENO[2,3-E]INDAZOLE COMPOUND 杏林製薬株式会社 (JP) 2011-06-30 WO disclosed