SCHEMBL22901547

SCHEMBL22901547

COc1cccc(COc2cccc3ccc(-c4nccc(C)n4)nc23)c1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.51
KMT2A Q03164 3/20 0.51
MAPT P10636 2/20 0.49
HTT P42858 2/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
GCK P35557 1/20 0.46
ABCB1 P08183 6/20 0.45
HTR1A P08908 3/20 0.45
DRD2 P14416 3/20 0.45
SGMS2 Q8NHU3 1/20 0.42
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
HPGD P15428 1/20 0.41
MAOB P27338 1/20 0.41
MPO P05164 1/20 0.41
PIM1 P11309 1/20 0.41
PIM2 Q9P1W9 1/20 0.41

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
SCHEMBL22901583 0.90 MAPT (0.52) MEN1KMT2AMAPTHTTSMN1; SMN2
SCHEMBL22901567 0.90 MAPT (0.51) MEN1KMT2AMAPTHTTSMN1; SMN2
SCHEMBL22901548 0.90 MAPT (0.45) MEN1KMT2AMAPTHTTSMN1; SMN2
SCHEMBL22901560 0.89 MAPT (0.47) MEN1KMT2AMAPTHTTSMN1; SMN2
SCHEMBL22901561 0.89 MAOB (0.46) MEN1KMT2AMAPTHTTSMN1; SMN2
SCHEMBL22901552 0.88 MAPT (0.43) MEN1KMT2AMAPTHTTSMN1; SMN2
SCHEMBL9951098 0.85 MEN1 (0.67) MEN1KMT2AMAPTHTTSMN1; SMN2
SCHEMBL22901554 0.85 MAPT (0.51) MEN1KMT2AMAPTHTTSMN1; SMN2
SCHEMBL22901562 0.84 MAPT (0.50) MEN1KMT2AMAPTHTTSMN1; SMN2
SCHEMBL22901622 0.84 MAPT (0.50) MEN1KMT2AMAPTHTTSMN1; SMN2

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-2021008588-A1 CLASS OF PYRIMIDINE QUINOLINE DERIVATIVES AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 广州新民培林医药科技有限公司 2021-01-21 WO disclosed