SCHEMBL10529318

SCHEMBL10529318

O=C(O)Oc1ccc2ccccc2c1-c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
WDR5 P61964 1/20 0.49
MAPT P10636 1/20 0.46
NCEH1 Q6PIU2 11/20 0.43
LMNA P02545 1/20 0.42
ALOX5 P09917 1/20 0.41
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
HPGD P15428 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
LDHA P00338 1/20 0.40

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
SCHEMBL9654427 0.91 MAPT (0.55) WDR5MAPTNCEH1LMNAKDM4E
SCHEMBL27994957 0.87 NCEH1 (0.48) WDR5MAPTNCEH1LMNAKDM4E
SCHEMBL9138037 0.83 GSK3B (0.47) WDR5MAPTNCEH1KDM4EALDH1A1
SCHEMBL28784940 0.82 SLC6A9 (0.42) KDM4EALDH1A1HPGDTDP1
SCHEMBL1156688 0.81 ALDH1A1 (0.43) MAPTKDM4EALDH1A1HPGDTDP1
SCHEMBL28784943 0.81 PPARG (0.42) MAPTTDP1
SCHEMBL28365601 0.80 MAPT (0.53) WDR5MAPTLMNAALOX5ALDH1A1
SCHEMBL10752267 0.79 WDR5 (0.40) WDR5MAPTNCEH1LMNAALOX5
SCHEMBL10752270 0.79 WDR5 (0.40) WDR5MAPTNCEH1LMNAALOX5
SCHEMBL7761409 0.79 LDHA (0.55) WDR5NCEH1LMNALDHA

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
US-4853361-A FLUORAN-TYPE LEUCO DYES JUJO PAPER CO., LTD. (JP) 1989-08-01 US disclosed