SCHEMBL8252001

SCHEMBL8252001

C=CC[C@H]1C(=O)N[C@@H]1C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
IDUA P35475 1/20 0.41
ALDH1A1 P00352 1/20 0.41
FAAH O00519 1/20 0.33
PRSS1 P07477 2/20 0.31
CTRC Q99895 2/20 0.31
F2 P00734 1/20 0.31

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
SCHEMBL2036819 0.74 IDUA (0.45) IDUA
SCHEMBL8259632 0.73 ELANE (0.46) ALDH1A1F2
SCHEMBL11199054 0.72 IDUA (0.44) IDUA
SCHEMBL1154518 0.68 ALDH1A1 (0.52) ALDH1A1PRSS1CTRCF2
SCHEMBL11034174 0.67 ALDH1A1 (0.36) ALDH1A1
SCHEMBL10345824 0.67 CTRB1 (0.40) IDUA
SCHEMBL8651576 0.65 MME (0.39) ALDH1A1FAAH
SCHEMBL1483113 0.63 ALDH1A1 (0.52) ALDH1A1
SCHEMBL14764661 0.63 ALDH1A1 (0.42) ALDH1A1
SCHEMBL11540103 0.61 ITGB1 (0.38) IDUAALDH1A1

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
WO-2006108039-A2 SUBSTITUTED AZETIDINONES DAIAMED, INC. (US) 2006-10-12 WO disclosed