SCHEMBL9192202

SCHEMBL9192202

CC(C(=O)OCCN1C(C)(C)CC(OC(=O)CCc2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)CC1(C)C)c1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.38
GAA P10253 5/20 0.36
MAOB P27338 3/20 0.34
MAOA P21397 2/20 0.34
PKM P14618 1/20 0.33
HTT P42858 1/20 0.33
HMGCR P04035 2/20 0.33
ACHE P22303 1/20 0.33
CACNA1A O00555 1/20 0.32
CACNA2D1 P54289 1/20 0.32
CACNB1 Q02641 1/20 0.32
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
TDP1 Q9NUW8 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
SCHEMBL2775346 0.93 KMT2A (0.38) KMT2AMEN1GAAMAOBMAOA
SCHEMBL206978 0.90 KMT2A (0.43) KMT2AMEN1GAAMAOBMAOA
SCHEMBL11449728 0.84 KMT2A (0.45) KMT2AMEN1GAAMAOBMAOA
SCHEMBL2958675 0.84 ALOX5 (0.44) KMT2AMEN1GAAMAOBMAOA
SCHEMBL5415492 0.84 GAA (0.34) KMT2AMEN1GAAMAOBMAOA
SCHEMBL17238847 0.84 KMT2A (0.36) KMT2AMEN1GAAMAOBMAOA
SCHEMBL2998267 0.84 APP (0.40) KMT2AMEN1GAAMAOBMAOA
SCHEMBL994414 0.83 KMT2A (0.47) KMT2AMEN1GAAMAOBMAOA
SCHEMBL30924771 0.83 KMT2A (0.41) KMT2AMEN1GAAMAOBMAOA
SCHEMBL17866245 0.83 KMT2A (0.38) KMT2AMEN1GAAMAOBMAOA

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-0359276-B1 Stabilized synthetic resin composition ASAHI DENKA KOGYO KK (JP) 1995-08-30 EP disclosed