SCHEMBL7207053

SCHEMBL7207053

CC(C)(C)OC(=O)N1CCCC1c1ccc2c(c1)NC(=O)C2

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 3/20 0.46
CRBN Q96SW2 2/20 0.44
DDB1 Q16531 1/20 0.44
NR1H2 P55055 4/20 0.42
RXRA P19793 3/20 0.42
NR1H3 Q13133 3/20 0.42
CPT1A P50416 2/20 0.40
CPT2 P23786 1/20 0.40
RIPK1 Q13546 2/20 0.40
LMNA P02545 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
NPC1 O15118 2/20 0.39
ALDH1A1 P00352 1/20 0.39
EIF2AK2 P19525 1/20 0.39
RAB9A P51151 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
SCHEMBL2885375 0.81 CRBN (0.52) CRBNDDB1NPC1RAB9A
SCHEMBL3663041 0.77 UCHL1 (0.44) HSD11B1CRBNDDB1NR1H2RXRA
SCHEMBL6526185 0.77 UCHL1 (0.44) HSD11B1CRBNDDB1NR1H2RXRA
SCHEMBL21611379 0.75 RIPK1 (0.52) RIPK1LMNANPSR1NPC1ALDH1A1
SCHEMBL22772314 0.75 RIPK1 (0.52) RIPK1LMNANPSR1NPC1ALDH1A1
SCHEMBL23064586 0.75 RIPK1 (0.52) RIPK1LMNANPSR1NPC1ALDH1A1
SCHEMBL22688967 0.75 NPSR1 (0.54) RIPK1LMNANPSR1NPC1ALDH1A1
SCHEMBL17151023 0.75 NPSR1 (0.54) RIPK1LMNANPSR1NPC1ALDH1A1
SCHEMBL27284775 0.74 ALDH1A1 (0.42) RIPK1LMNANPSR1NPC1ALDH1A1
SCHEMBL1778275 0.74 NR1H2 (0.53) NR1H2NR1H3RIPK1LMNANPSR1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0912557-B1 OXINDOLE DERIVATIVES ASTRAZENECA AB (SE) 2003-07-09 EP disclosed
US-6265411-B1 ANGIOGENESIS INHIBITOR ZENECA LIMITED (GB) 2001-07-24 US disclosed
EP-0912557-A1 OXINDOLE DERIVATIVES ZENECA LIMITED (GB) 1999-05-06 EP disclosed
WO-1997042187-A1 OXINDOLE DERIVATIVES ZENECA LIMITED (GB) 1997-11-13 WO disclosed