SCHEMBL15711684

SCHEMBL15711684

C=C=COOCCCCOc1ccc(OCOc2ccc(OC(=O)c3ccc(C=C)cc3)cc2C)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.36
KMT2A Q03164 2/20 0.36
PPARD Q03181 3/20 0.34
NPC1 O15118 2/20 0.34
LMNA P02545 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
PPARG P37231 2/20 0.34
TDP1 Q9NUW8 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
PPARA Q07869 1/20 0.34
NFKB1 P19838 1/20 0.34
NFKB2 Q00653 1/20 0.34
RELA Q04206 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
PRSS1 P07477 1/20 0.33
ACR P10323 1/20 0.33

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
SCHEMBL12284993 0.90 MAPT (0.35) MAPTKMT2APPARDNPC1LMNA
SCHEMBL15711685 0.89 KMT2A (0.36) MAPTKMT2ANPC1LMNAL3MBTL1
SCHEMBL9996677 0.89 HTT (0.35) MAPTKMT2APPARDNPC1LMNA
SCHEMBL9996738 0.88 PPARD (0.35) MAPTKMT2APPARDNPC1LMNA
SCHEMBL102853 0.86 TDP1 (0.39) MAPTKMT2APPARDNPC1LMNA
SCHEMBL12567135 0.85 MAPT (0.31) MAPTKMT2A
SCHEMBL12567143 0.84 HTT (0.31) MAPTKMT2ANPC1LMNANFKB1
SCHEMBL18027625 0.83 MAPT (0.33) MAPTKMT2APPARDNPC1LMNA
SCHEMBL12567139 0.83 PPARG (0.31) MAPTKMT2APPARDPPARGPPARA
SCHEMBL13774490 0.79 KMT2A (0.42) MAPTKMT2ANPC1LMNAL3MBTL1

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-RE44890-E1 Authenticity indicator DAI NIPPON PRINTING CO., LTD. (JP) 2014-05-13 US disclosed