SCHEMBL10915218

SCHEMBL10915218

Cc1cc(O)c2ccccc2c1OP(=O)(O)OP(=O)(O)O.[NaH].[NaH].[NaH].[NaH]

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.52
MAPT P10636 3/20 0.52
GAA P10253 3/20 0.52
KDM4E B2RXH2 2/20 0.52
TP53 P04637 1/20 0.52
HSD17B10 Q99714 1/20 0.52
LMNA P02545 2/20 0.44
SRC P12931 3/20 0.39
P2RY2 P41231 1/20 0.34
POLB P06746 2/20 0.33
MEN1 O00255 1/20 0.33
NSD2 O96028 1/20 0.33
KMT2A Q03164 1/20 0.33
MCL1 Q07820 1/20 0.33
PTPN1 P18031 1/20 0.33
EP300 Q09472 1/20 0.33
TRPM4 Q8TD43 1/20 0.32
THRB P10828 1/20 0.31

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
SCHEMBL4338968 0.88 HTT (0.58) HTTMAPTGAAKDM4ETP53
SCHEMBL7534018 0.79 MAPT (0.58) HTTMAPTGAAKDM4ETP53
Vitamin K3H2 SCHEMBL9223417 0.77 HTT (0.70) HTTMAPTGAAKDM4ETP53
SCHEMBL28272502 0.73 SRC (0.44) MAPTGAAKDM4EHSD17B10LMNA
Resorcinol SCHEMBL20361676 0.72 SRC (0.41) MAPTHSD17B10LMNASRCMEN1
Vitamin K3H2 SCHEMBL27560223 0.72 HTT (0.78) HTTMAPTGAAKDM4ETP53
SCHEMBL9812714 0.71 KDM4E (0.64) HTTMAPTGAAKDM4ETP53
Menadiol Diphosphoric Acid SCHEMBL515181 0.71 HTT (0.51) HTTMAPTGAAKDM4ETP53
Hydroquinone SCHEMBL9718301 0.71 SRC (0.40) MAPTGAAKDM4EHSD17B10LMNA
Vitamin K3H2 SCHEMBL987810 0.70 HTT (0.75) HTTMAPTGAAKDM4ETP53

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
JP-61215305-A None JP disclosed
JP-S61215305-A PLANT GROWTH REGULATOR TOMOE KAGAKU KOGYO KK 1986-09-25 JP disclosed