SCHEMBL4396669

SCHEMBL4396669

Cc1ccccc1C(=O)OCC(=O)NC1C2CC3CC(C2)CC1C3

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
THRB P10828 4/20 0.60
TDP1 Q9NUW8 1/20 0.48
NPC1 O15118 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
ATM Q13315 1/20 0.46
KMT2A Q03164 2/20 0.45
MEN1 O00255 1/20 0.45
L3MBTL1 Q9Y468 2/20 0.44
KDM4E B2RXH2 1/20 0.44
RAB9A P51151 1/20 0.43

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
SCHEMBL13634586 0.80 NPC1 (0.56) NPC1SMN1; SMN2KMT2AMEN1RAB9A
SCHEMBL3456922 0.80 MEN1 (0.61) TDP1SMN1; SMN2KMT2AMEN1L3MBTL1
SCHEMBL4404236 0.73 EPHX2 (0.52) THRBNPC1KMT2AMEN1RAB9A
SCHEMBL4117717 0.73 CNR2 (0.61) TDP1SMN1; SMN2KMT2AKDM4E
SCHEMBL28854265 0.70 MEN1 (0.65) TDP1NPC1SMN1; SMN2KMT2AMEN1
SCHEMBL27581546 0.70 MEN1 (0.60) TDP1NPC1SMN1; SMN2KMT2AMEN1
SCHEMBL19808478 0.69 EPHX2 (0.66) KMT2AL3MBTL1
SCHEMBL4784023 0.68 RAB9A (0.66) TDP1NPC1KMT2AMEN1RAB9A
SCHEMBL1569293 0.68 TSHR (0.80) TDP1NPC1SMN1; SMN2KMT2AMEN1
SCHEMBL29535471 0.68 TSHR (0.80) TDP1NPC1SMN1; SMN2KMT2AMEN1

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
EP-1796657-B1 N-2 ADAMANTANYL-2-PHENOXY-ACETAMIDE DERIVATIVES AS 11-BETA HYDROXYSTEROID DEHYDROGENASE INHIBITORS JANSSEN PHARMACEUTICA NV (BE) 2009-12-23 EP claimed