SCHEMBL5983320

SCHEMBL5983320

COC(=O)COC1(NC(=O)OC(C)(C)C)C=CC(c2ccccc2)=CC1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.34
LMNA P02545 1/20 0.34
ATM Q13315 1/20 0.34
CACNA1G O43497 3/20 0.34
CTSS P25774 3/20 0.34
CTSK P43235 2/20 0.34
CTSL P07711 1/20 0.33
CTSB P07858 1/20 0.33
MTNR1A P48039 1/20 0.33
MTNR1B P49286 1/20 0.33
ACACB O00763 1/20 0.33
ACACA Q13085 1/20 0.33
PPARA Q07869 2/20 0.33
PPARG P37231 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
MAPT P10636 1/20 0.33
KMT2A Q03164 1/20 0.33
KLK5 Q9Y337 1/20 0.32
ACE P12821 1/20 0.32

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
SCHEMBL5983441 0.78 NFKB1 (0.36) ALDH1A1LMNAATMCTSSCTSK
Methane SCHEMBL27537449 0.77 NFKB1 (0.36) ALDH1A1LMNAATMCTSSCTSK
SCHEMBL5984433 0.73 ALDH1A1 (0.36) ALDH1A1CACNA1GKDM4EMEN1MAPT
SCHEMBL28459748 0.68 KLK5 (0.36) ATMCTSSCTSKCTSLCTSB
SCHEMBL8970782 0.67 MEN1 (0.38) ALDH1A1KDM4EMEN1MAPTKMT2A
SCHEMBL28461037 0.67 CTSS (0.36) ATMCTSSCTSKCTSLCTSB
SCHEMBL28443486 0.66 KCNN4 (0.36) ALDH1A1LMNAMEN1MAPTKMT2A
SCHEMBL5182782 0.65 MEN1 (0.39) ALDH1A1KDM4EMEN1MAPTKMT2A
SCHEMBL19746580 0.65 MEN1 (0.42) ALDH1A1KDM4EMEN1MAPTKMT2A
SCHEMBL23928823 0.65 NFKB1 (0.37) ALDH1A1LMNACTSSCTSKCTSL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1667959-A1 BIPHENYLOXY-ACIDS Wyeth (US) 2006-06-14 EP disclosed
WO-2005030702-A1 BIPHENYLOXY-ACIDS WYETH (US) 2005-04-07 WO disclosed