SCHEMBL8558518

SCHEMBL8558518

CCCCCc1ccc(O)c2c1N(Cc1ccccc1)C(=O)C2(C)C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 5/20 0.48
BID P55957 3/20 0.39
MCL1 Q07820 3/20 0.39
BCL2L1 Q07817 2/20 0.39
BAK1 Q16611 2/20 0.39
KAT8 Q9H7Z6 2/20 0.39
PPARG P37231 1/20 0.39
PPARA Q07869 1/20 0.39
EP300 Q09472 1/20 0.39
KAT2A Q92830 1/20 0.39
KAT2B Q92831 1/20 0.39
KAT5 Q92993 1/20 0.39
SAE1 Q9UBE0 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
CTSG P08311 3/20 0.38
PRTN3 P24158 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
RGS12 O14924 1/20 0.37

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
SCHEMBL8553469 0.97 ELANE (0.49) ELANENPSR1CTSGPRTN3TDP1
SCHEMBL8557250 0.92 ELANE (0.51) ELANEMCL1NPSR1CTSGPRTN3
SCHEMBL8960633 0.81 TYR (0.37) ELANEBIDMCL1BCL2L1BAK1
SCHEMBL8556687 0.79 ELANE (0.56) ELANEMCL1EP300NPSR1CTSG
SCHEMBL8555587 0.72 ELANE (0.54) ELANEMCL1EP300NPSR1CTSG
SCHEMBL8960950 0.71 PRKCI (0.37) ELANEEP300CTSGLMNAALDH1A1
SCHEMBL23580135 0.67 ELANE (0.61) ELANENPSR1CTSGPRTN3TDP1
SCHEMBL16281890 0.67 EGLN1 (0.60) MEN1KMT2ALMNAHTT
SCHEMBL8559099 0.66 TYR (0.44) ELANEBIDMCL1BCL2L1BAK1
SCHEMBL23580631 0.66 ELANE (0.59) ELANENPSR1CTSGPRTN3TDP1

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
EP-0653426-B1 Indole derivatives, salts thereof and heart affection therapeutic agent comprising the same KOWA CO (JP) 1998-07-22 EP disclosed
EP-0653426-A1 Indole derivatives, salts thereof and heart affection therapeutic agent comprising the same KOWA COMPANY, LTD. (JP) 1995-05-17 EP disclosed