SCHEMBL10513435

SCHEMBL10513435

O=c1cc[nH]c(-c2ccccc2)c1-c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.46
KDM4E B2RXH2 2/20 0.46
PLA2G10 O15496 1/20 0.46
GAA P10253 1/20 0.46
HPGD P15428 1/20 0.46
HSD17B10 Q99714 1/20 0.46
MAPT P10636 3/20 0.46
LMNA P02545 1/20 0.46
HTT P42858 1/20 0.46
ESR1 P03372 3/20 0.45
ESR2 Q92731 3/20 0.45
NOTUM Q6P988 2/20 0.45
GLA P06280 1/20 0.40
POLB P06746 1/20 0.40
RAB9A P51151 1/20 0.40
KMT2A Q03164 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
PIM1 P11309 1/20 0.39
GFER P55789 1/20 0.39
TDP1 Q9NUW8 1/20 0.39

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
SCHEMBL9526229 0.77 ALDH1A1 (0.46) ALDH1A1KDM4EPLA2G10GAAHPGD
SCHEMBL19357929 0.74 MAPT (0.46) ALDH1A1KDM4EPLA2G10GAAHPGD
SCHEMBL10754874 0.74 KDM4E (0.42) ALDH1A1KDM4EPLA2G10GAAHPGD
SCHEMBL8052187 0.69 ESR1 (0.41) ALDH1A1KDM4EPLA2G10GAAHPGD
SCHEMBL10513556 0.69 PARP1 (0.48) ALDH1A1KDM4EPLA2G10GAAHPGD
SCHEMBL15012731 0.69 MAPT (0.41) ALDH1A1KDM4EPLA2G10GAAHPGD
SCHEMBL3976914 0.68 MAPT (0.63) ALDH1A1MAPTLMNAHTTNOTUM
SCHEMBL3424232 0.67 MAPT (0.52) ALDH1A1KDM4EPLA2G10GAAHPGD
SCHEMBL692156 0.67 MAPT (0.56) ALDH1A1HPGDHSD17B10MAPTLMNA
SCHEMBL29031883 0.67 SERPINE1 (0.67) ALDH1A1KDM4EPLA2G10GAAHPGD

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
EP-0304057-A2 Pyridinone derivatives, and agricultural and horticultural fungicidal compositions containing the same KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 1989-02-22 EP disclosed