SCHEMBL11064077

SCHEMBL11064077

C=CCNc1cccc(C(=O)CCC(=O)OC)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.43
RXFP1 Q9HBX9 1/20 0.43
KDM4E B2RXH2 3/20 0.42
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
ALDH1A1 P00352 2/20 0.42
HPGD P15428 2/20 0.42
HSP90AA1 P07900 1/20 0.42
HTT P42858 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
FFAR1 O14842 1/20 0.41
CTDSP1 Q9GZU7 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
LMNA P02545 1/20 0.40
GAA P10253 1/20 0.40
AKR1C3 P42330 1/20 0.40
CTNNB1 P35222 1/20 0.39

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
SCHEMBL11075790 0.85 NR4A2 (0.49) KDM4ENPC1RAB9AALDH1A1HPGD
SCHEMBL11306407 0.83 GAA (0.45) KDM4ENPC1RAB9AALDH1A1HPGD
SCHEMBL11070198 0.83 ALDH1A1 (0.48) TP53RXFP1KDM4ENPC1RAB9A
SCHEMBL11073671 0.82 EGFR (0.54) TP53NPC1RAB9AALDH1A1HPGD
SCHEMBL10832665 0.80 AKR1C3 (0.45) KDM4ENPC1RAB9AALDH1A1HPGD
SCHEMBL370664 0.79 AKR1C3 (0.44) KDM4ENPC1RAB9AALDH1A1HPGD
SCHEMBL877659 0.77 AKR1C3 (0.59) KDM4ENPC1RAB9AALDH1A1HPGD
SCHEMBL11073937 0.77 SLC7A5 (0.47) TP53KDM4ENPC1RAB9AALDH1A1
SCHEMBL11704492 0.76 ALDH1A1 (0.52) KDM4ENPC1RAB9AALDH1A1FFAR1
SCHEMBL370685 0.76 HCAR3 (0.44) KDM4ENPC1RAB9AKMT2AMEN1

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
US-4440940-A HYPOLIPIDEMIC AND ANTIATHEROSCLEROTIC AGENTS AMERICAN CYANAMID COMPANY (US) 1984-04-03 US disclosed