SCHEMBL6578260

SCHEMBL6578260

C#CCOc1ccc(CCNC(=O)CCc2ccc(C)cc2)cc1OC

nearest known ligand 0.64

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.64
MEN1 O00255 3/20 0.64
ALDH1A1 P00352 4/20 0.62
MAPT P10636 3/20 0.62
LMNA P02545 2/20 0.62
PKM P14618 1/20 0.57
SMN1; SMN2 Q16637 1/20 0.53
THRB P10828 1/20 0.53

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
SCHEMBL5957753 0.90 ALDH1A1 (0.56) KMT2AMEN1ALDH1A1MAPTLMNA
SCHEMBL6537275 0.85 MTNR1A (0.59) KMT2AMEN1ALDH1A1MAPTSMN1; SMN2
SCHEMBL6816867 0.84 ALDH1A1 (0.59) KMT2AMEN1ALDH1A1MAPTLMNA
SCHEMBL5957987 0.84 KMT2A (0.55) KMT2AMEN1ALDH1A1MAPTLMNA
SCHEMBL1548630 0.84 LMNA (0.54) KMT2AMEN1ALDH1A1MAPTLMNA
SCHEMBL1549160 0.84 LMNA (0.54) KMT2AMEN1ALDH1A1MAPTLMNA
SCHEMBL1548628 0.84 LMNA (0.54) KMT2AMEN1ALDH1A1MAPTLMNA
SCHEMBL5958304 0.83 HPGD (0.57) KMT2AMEN1ALDH1A1
SCHEMBL1549021 0.83 LMNA (0.53) KMT2AMEN1ALDH1A1MAPTLMNA
SCHEMBL1548635 0.83 LMNA (0.53) KMT2AMEN1ALDH1A1MAPTLMNA

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-1448514-A1 NOVEL ALPHA-OXYGENATED OR ALPHA-THIOLATED CARBOXYLIC ACID PHENETHYLAMIDE DERIVATIVES Syngenta Participations AG (CH) 2004-08-25 EP disclosed
WO-2003042168-A1 NOVEL α-OXYGENATED OR α-THIOLATED CARBOXYLIC ACID PHENETHYLAMIDE DERIVATIVES SYNGENTA PARTICIPATIONS AG (CH) 2003-05-22 WO disclosed