SCHEMBL7960034

SCHEMBL7960034

CC(=O)c1ccc(CC(=O)c2c(O)cc(C)oc2=O)s1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ELANE P08246 2/20 0.49
KMT2A Q03164 9/20 0.43
MEN1 O00255 8/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
ALDH1A1 P00352 5/20 0.41
GAA P10253 4/20 0.41
MAPT P10636 4/20 0.41
RAB9A P51151 4/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
KDM4E B2RXH2 1/20 0.40
HPGD P15428 1/20 0.40
USP2 O75604 2/20 0.40
PPARG P37231 1/20 0.40
TDP1 Q9NUW8 2/20 0.40
LMNA P02545 1/20 0.39
NPC1 O15118 2/20 0.39
PKM P14618 2/20 0.39
POLB P06746 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
SCHEMBL7950013 0.85 ELANE (0.52) ELANEKMT2AMEN1L3MBTL1ALDH1A1
SCHEMBL7958207 0.84 KMT2A (0.53) ELANEKMT2AMEN1L3MBTL1ALDH1A1
SCHEMBL7961868 0.76 ELANE (0.51) ELANEKMT2AMEN1L3MBTL1ALDH1A1
SCHEMBL7950033 0.75 ELANE (0.56) ELANEKMT2AMEN1L3MBTL1ALDH1A1
SCHEMBL7957681 0.75 ELANE (0.52) ELANEKMT2AMEN1L3MBTL1ALDH1A1
SCHEMBL7957661 0.74 ELANE (0.51) ELANEKMT2AMEN1L3MBTL1ALDH1A1
SCHEMBL7960988 0.74 ELANE (0.51) ELANEKMT2AMEN1L3MBTL1ALDH1A1
SCHEMBL1308058 0.74 KMT2A (0.59) ELANEKMT2AMEN1L3MBTL1ALDH1A1
SCHEMBL7958244 0.73 ELANE (0.57) ELANEKMT2AMEN1L3MBTL1ALDH1A1
SCHEMBL5781050 0.73 ELANE (0.50) ELANEKMT2AMEN1L3MBTL1ALDH1A1

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-6184245-B1 Cyclic ketone derivatives and their medical applications TORAY INDUSTRIES INC. (JP) 2001-02-06 US disclosed