SCHEMBL6894958

SCHEMBL6894958

O=C1C=CCN1C(=O)CC(O)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.36
BCAT2 O15382 1/20 0.36
MEN1 O00255 3/20 0.36
KMT2A Q03164 3/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CACNA1H O95180 1/20 0.35
CACNA2D1 P54289 1/20 0.35
CACNA1B Q00975 1/20 0.35
CACNB1 Q02641 1/20 0.35
CACNA1C Q13936 1/20 0.35
KDM4E B2RXH2 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
GABBR2 O75899 1/20 0.35
GABBR1 Q9UBS5 1/20 0.35
GAA P10253 1/20 0.35
DAO P14920 1/20 0.35
OPRM1 P35372 1/20 0.34
OPRD1 P41143 1/20 0.34

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
SCHEMBL16661772 0.75 NAAA (0.56)
SCHEMBL18654084 0.75 NAAA (0.56)
SCHEMBL14303692 0.70 HPGD (0.61) LMNAMEN1KMT2ANPC1CACNA1H
SCHEMBL904476 0.67 GABBR2 (0.55) LMNABCAT2NPC1RAB9ASMN1; SMN2
SCHEMBL9061130 0.67 LMNA (0.54) LMNABCAT2NPC1RAB9ASMN1; SMN2
SCHEMBL20658834 0.67
SCHEMBL904490 0.67 GABBR2 (0.55) LMNABCAT2NPC1RAB9ASMN1; SMN2
SCHEMBL186610 0.67 GABBR2 (0.55) LMNABCAT2NPC1RAB9ASMN1; SMN2
SCHEMBL18390245 0.67 GAA (0.58) CACNA1HCACNA2D1CACNA1BCACNB1CACNA1C
Hydrochloric Acid SCHEMBL1373206 0.66 GABBR2 (0.53) LMNABCAT2NPC1RAB9ASMN1; SMN2

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-6727275-B2 ANTIINFLAMMATORY, ANTIALLERGEN, AND ANTIASTHMATIC AGENTS UCB, S.A./N.V. (BE) 2004-04-27 US disclosed