SCHEMBL9818592

SCHEMBL9818592

CC(=O)c1ccc(NC(=O)NCC2(c3ccccc3)CCCCC2)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.63
LMNA P02545 4/20 0.58
L3MBTL1 Q9Y468 4/20 0.55
SMN1; SMN2 Q16637 3/20 0.55
ALDH1A1 P00352 2/20 0.55
POLB P06746 1/20 0.55
MAPK1 P28482 1/20 0.55
MAPT P10636 3/20 0.55
NPC1 O15118 2/20 0.55
RAB9A P51151 2/20 0.55
TAAR1 Q96RJ0 1/20 0.55
NPSR1 Q6W5P4 1/20 0.53
TP53 P04637 1/20 0.52
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
HSD17B10 Q99714 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
SLC6A4 P31645 1/20 0.50

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
SCHEMBL9818668 0.88 CNR1 (0.70) CNR1LMNAL3MBTL1SMN1; SMN2ALDH1A1
SCHEMBL9818621 0.87 CNR1 (0.66) CNR1LMNAL3MBTL1SMN1; SMN2ALDH1A1
SCHEMBL300331 0.87 CNR1 (0.72) CNR1LMNAL3MBTL1SMN1; SMN2ALDH1A1
SCHEMBL9818721 0.85 CNR1 (0.63) CNR1LMNAL3MBTL1SMN1; SMN2ALDH1A1
SCHEMBL9818576 0.85 LMNA (0.68) CNR1LMNAL3MBTL1SMN1; SMN2ALDH1A1
SCHEMBL9818691 0.85 CNR1 (0.66) CNR1LMNAL3MBTL1SMN1; SMN2ALDH1A1
SCHEMBL9818669 0.85 CNR1 (0.87) CNR1LMNAL3MBTL1SMN1; SMN2ALDH1A1
SCHEMBL9818694 0.84 CNR1 (0.62) CNR1L3MBTL1ALDH1A1POLBMAPT
SCHEMBL9818715 0.84 CNR1 (0.65) CNR1LMNAL3MBTL1SMN1; SMN2MAPK1
SCHEMBL9818724 0.82 CNR1 (0.63) CNR1LMNAL3MBTL1SMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5015644-A Antihyperlipidemic and antiatherosclerotic urea and carbamate compounds WARNER-LAMBERT COMPANY (US) 1991-05-14 US disclosed