SCHEMBL15225872

SCHEMBL15225872

COCCc1cc(O)cc(O)c1-c1cc[c]cc1

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PRKCE Q02156 2/20 0.33
MYLK Q15746 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
PRKCG P05129 1/20 0.33
MAPT P10636 1/20 0.33
PRKCA P17252 1/20 0.33
APEX1 P27695 1/20 0.33
RECQL P46063 1/20 0.33
KMT2A Q03164 1/20 0.33
NQO1 P15559 1/20 0.32
TYR P14679 1/20 0.30

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
SCHEMBL15225871 0.76 MEN1 (0.30) PRKCEMYLKTDP1MEN1ALDH1A1
SCHEMBL28309698 0.75 NQO1 (0.54) TDP1MEN1ALDH1A1MAPTAPEX1
SCHEMBL15225300 0.74
SCHEMBL15225789 0.74
SCHEMBL15225696 0.71 KCNA3 (0.33) MEN1MAPTRECQLKMT2A
SCHEMBL22991754 0.69 TYR (0.65) TDP1MEN1MAPTKMT2ATYR
SCHEMBL6941560 0.69 ALDH1A1 (0.51) ALDH1A1TYR
SCHEMBL5800316 0.65 ACACB (0.41) ALDH1A1MAPT
SCHEMBL2862068 0.64 LMNA (0.48) TDP1MEN1ALDH1A1MAPTRECQL
SCHEMBL198568 0.64 NR3C1 (0.36) TDP1

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-1642880-B1 HSP90 FAMILY PROTEIN INHIBITORS KYOWA HAKKO KIRIN CO LTD (JP) 2013-09-04 EP claimed