SCHEMBL14348141

SCHEMBL14348141

C/C=C/C[C@H](C(N)=O)[C@@H](CC(C)C)C(=O)NCC

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 2/20 0.33
GRIK2 Q13002 2/20 0.33
ECE1 P42892 1/20 0.31
CAPN1 P07384 1/20 0.31
NOTCH1 P46531 1/20 0.31
RBPJ Q06330 1/20 0.31
PPARG P37231 1/20 0.31
PPARD Q03181 1/20 0.31
PPARA Q07869 1/20 0.31
FCER2 P06734 1/20 0.30
MMP1 P03956 1/20 0.30
MMP2 P08253 1/20 0.30
MMP3 P08254 1/20 0.30
MMP7 P09237 1/20 0.30

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
SCHEMBL8427682 1.00 GRIK1 (0.33) GRIK1GRIK2ECE1CAPN1NOTCH1
SCHEMBL14348063 0.84 MMP2 (0.43) NOTCH1RBPJMMP1MMP2MMP3
SCHEMBL8427651 0.84 MMP2 (0.43) NOTCH1RBPJMMP1MMP2MMP3
SCHEMBL8426501 0.81 CTSK (0.32)
SCHEMBL14348085 0.81 CTSK (0.32)
SCHEMBL8235462 0.81 MMP1 (0.34) GRIK1GRIK2FCER2MMP1MMP2
SCHEMBL14117556 0.81 MMP1 (0.34) GRIK1GRIK2FCER2MMP1MMP2
SCHEMBL14375169 0.81 CTSK (0.32)
SCHEMBL14347675 0.81 ECE1 (0.32) GRIK1GRIK2ECE1
SCHEMBL13913518 0.81 ECE1 (0.32) GRIK1GRIK2ECE1

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
US-7304056-B2 Succinoylamino lactams as inhibitors of Aβ protein production BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2007-12-04 US disclosed
US-7304049-B2 Succinoylaminobenzodiazepines as inhibitors of Aβ protein production BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2007-12-04 US disclosed