SCHEMBL9823927

SCHEMBL9823927

COC(=O)C(=Cc1ccccc1)NC(=O)C=CC(=O)O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.46
MEN1 O00255 2/20 0.46
LMNA P02545 4/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
ALDH1A1 P00352 9/20 0.45
NPSR1 Q6W5P4 2/20 0.45
HTT P42858 2/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C19 P33261 1/20 0.44
TAAR1 Q96RJ0 2/20 0.42
GAA P10253 1/20 0.42
KDM4E B2RXH2 2/20 0.42
HPGD P15428 2/20 0.42
HDAC3 O15379 1/20 0.41
TNKS O95271 1/20 0.41
HDAC4 P56524 1/20 0.41
HDAC1 Q13547 1/20 0.41
HCAR2 Q8TDS4 1/20 0.41
HDAC7 Q8WUI4 1/20 0.41
HDAC2 Q92769 1/20 0.41

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
SCHEMBL187458 0.84 MEN1 (0.56) KMT2AMEN1LMNASMN1; SMN2ALDH1A1
SCHEMBL186729 0.84 MEN1 (0.56) KMT2AMEN1LMNASMN1; SMN2ALDH1A1
SCHEMBL3682708 0.84 MEN1 (0.56) KMT2AMEN1LMNASMN1; SMN2ALDH1A1
SCHEMBL12394376 0.81 LMNA (0.49) KMT2AMEN1LMNASMN1; SMN2ALDH1A1
SCHEMBL7522147 0.80 MEN1 (0.47) KMT2AMEN1LMNASMN1; SMN2ALDH1A1
SCHEMBL8008079 0.80 LMNA (0.46) KMT2AMEN1LMNASMN1; SMN2ALDH1A1
SCHEMBL9488339 0.80 LMNA (0.46) KMT2AMEN1LMNASMN1; SMN2ALDH1A1
SCHEMBL9488336 0.80 LMNA (0.46) KMT2AMEN1LMNASMN1; SMN2ALDH1A1
SCHEMBL7642884 0.78 LMNA (0.69) KMT2AMEN1LMNASMN1; SMN2ALDH1A1
SCHEMBL20223419 0.77 ITGB1 (0.47) KMT2AMEN1LMNASMN1; SMN2ALDH1A1

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
JP-3153653-A None JP disclosed
JP-H03153653-A N-(1-ALKOXYCARBONYLSTYRYL)FUMARAMIC ACID AND PRODUCTION THEREOF KURARAY CO LTD 1991-07-01 JP disclosed