SCHEMBL9699425

SCHEMBL9699425

C=CCOC(=O)C(=C)C(=O)O.C=CN1CCCC1=O

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.32
LMNA P02545 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
SCHEMBL721712 0.85 KMT2A (0.33) KMT2ALMNA
SCHEMBL7912887 0.82
SCHEMBL29407115 0.81 ALDH1A1 (0.37) KMT2A
SCHEMBL15021278 0.81
SCHEMBL11253245 0.81 MAPT (0.43) KMT2ALMNA
SCHEMBL11253248 0.81 MAPT (0.43) KMT2ALMNA
SCHEMBL7909333 0.80
SCHEMBL28907379 0.80
SCHEMBL29430956 0.78 ALDH1A1 (0.34)
SCHEMBL29353135 0.78 THRB (0.34)

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
WO-1992002572-A1 ASSOCIATIVE REACTIVE BLEND-CONTAINING COMPOSITIONS DSM N.V. (NL) 1992-02-20 WO claimed
WO-1992002572-A1 ASSOCIATIVE REACTIVE BLEND-CONTAINING COMPOSITIONS DSM N.V. (NL) 1992-02-20 WO disclosed