SCHEMBL9544506

SCHEMBL9544506

CN(C)C=C(NC(=O)c1ccccc1)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.50
LMNA P02545 4/20 0.46
MAPT P10636 4/20 0.45
ALDH1A1 P00352 6/20 0.45
RAB9A P51151 4/20 0.45
NPC1 O15118 3/20 0.45
KMT2A Q03164 3/20 0.45
MEN1 O00255 2/20 0.45
GLA P06280 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
CHIA Q9BZP6 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
RECQL P46063 1/20 0.43
PKM P14618 1/20 0.43
GAA P10253 1/20 0.42
EPHX1 P07099 1/20 0.42
HDAC3 O15379 1/20 0.42
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
IDO1 P14902 1/20 0.42

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
SCHEMBL28117069 1.00 KDM4E (0.50) KDM4ELMNAMAPTALDH1A1RAB9A
SCHEMBL2498114 0.88 KDM4E (0.49) KDM4ELMNAMAPTALDH1A1RAB9A
SCHEMBL2116400 0.88 KDM4E (0.49) KDM4ELMNAMAPTALDH1A1RAB9A
SCHEMBL2116399 0.88 KDM4E (0.49) KDM4ELMNAMAPTALDH1A1RAB9A
SCHEMBL12112859 0.85 LMNA (0.59) KDM4ELMNAALDH1A1RAB9ANPC1
SCHEMBL1307670 0.85 LMNA (0.59) KDM4ELMNAALDH1A1RAB9ANPC1
SCHEMBL1307672 0.85 LMNA (0.59) KDM4ELMNAALDH1A1RAB9ANPC1
SCHEMBL9750183 0.82 ALDH1A1 (0.50) KDM4ELMNAMAPTALDH1A1RAB9A
SCHEMBL9750169 0.82 ALDH1A1 (0.50) KDM4ELMNAMAPTALDH1A1RAB9A
SCHEMBL9750180 0.82 ALDH1A1 (0.50) KDM4ELMNAMAPTALDH1A1RAB9A

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
WO-1993009173-A1 USE OF 3-AMINO-2(BENZOYLAMINO)ACRYLIC ACID ESTERS AS STABILISERS FOR ORGANIC MATERIALS BASF AKTIENGESELLSCHAFT (DE) 1993-05-13 WO disclosed