SCHEMBL30327005

SCHEMBL30327005

Cc1cc(N(C)C)ccc1C(c1ccccc1)c1ccccc1O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.41
GAA P10253 2/20 0.41
PKM P14618 1/20 0.41
HTT P42858 1/20 0.41
MCL1 Q07820 1/20 0.41
ALDH1A1 P00352 4/20 0.36
KDM4E B2RXH2 1/20 0.36
GABRA1 P14867 1/20 0.36
GABRB2 P47870 1/20 0.36
TYR P14679 1/20 0.36
TSHR P16473 2/20 0.34
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
LMNA P02545 2/20 0.34
KCNH2 Q12809 2/20 0.34
ESR1 P03372 1/20 0.34
CHRM2 P08172 1/20 0.34
CHRM4 P08173 1/20 0.34
CHRM5 P08912 1/20 0.34
CHRM1 P11229 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
SCHEMBL75642 0.89 MAPT (0.41) MAPTGAAPKMHTTMCL1
SCHEMBL28296896 0.82 CHRM1 (0.43) MAPTGAAHTTALDH1A1GABRA1
SCHEMBL30327071 0.82 ALDH1A1 (0.45) MAPTGAAALDH1A1KDM4EGABRA1
SCHEMBL376187 0.81 ALDH1A1 (0.40) MAPTGAAPKMHTTMCL1
SCHEMBL11331423 0.80 APP (0.41) MAPTGAAPKMHTTMCL1
SCHEMBL4314898 0.80 MAPT (0.36) MAPTGAAPKMHTTMCL1
SCHEMBL19886263 0.80 MAPT (0.44) MAPTGAAPKMHTTMCL1
SCHEMBL5921994 0.80 SLC2A1 (0.47) MAPTGAAPKMHTTMCL1
SCHEMBL11672106 0.79 ALDH1A1 (0.43) MAPTGAAALDH1A1KDM4ETYR
SCHEMBL13649911 0.78 SLC2A1 (0.46) MAPTGAAALDH1A1KDM4EGABRA1

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
CN-111484420-B Method for synthesizing triarylmethane derivative and triarylmethane derivative obtained by same 天津师范大学 2023-04-04 CN disclosed
CN-111484419-B Method for synthesizing triarylmethane derivative 天津师范大学 2023-03-31 CN disclosed