SCHEMBL8235462

SCHEMBL8235462

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

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 6/20 0.34
MMP2 P08253 6/20 0.34
MMP3 P08254 5/20 0.34
MMP7 P09237 3/20 0.34
GRIK1 P39086 2/20 0.33
GRIK2 Q13002 2/20 0.33
MMP9 P14780 3/20 0.32
MMP8 P22894 3/20 0.32
TNF P01375 2/20 0.32
ADAM17 P78536 2/20 0.32
MMP13 P45452 2/20 0.32
MMP20 O60882 1/20 0.32
ADAMTS4 O75173 1/20 0.32
MMP10 P09238 1/20 0.32
MMP12 P39900 1/20 0.32
MMP14 P50281 1/20 0.32
MMP15 P51511 1/20 0.32
MMP16 P51512 1/20 0.32
MMP25 Q9NPA2 1/20 0.32
MMP26 Q9NRE1 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
SCHEMBL14117556 1.00 MMP1 (0.34) MMP1MMP2MMP3MMP7GRIK1
SCHEMBL8244322 0.84 MMP2 (0.48) MMP1MMP2MMP3MMP7MMP9
SCHEMBL14117560 0.84 CTSK (0.33) GRIK1GRIK2CTSKHDAC2
SCHEMBL8244221 0.84 CTSK (0.33) GRIK1GRIK2CTSKHDAC2
SCHEMBL14117533 0.84 MMP2 (0.48) MMP1MMP2MMP3MMP7MMP9
SCHEMBL14348141 0.81 GRIK1 (0.33) MMP1MMP2MMP3MMP7GRIK1
SCHEMBL8235538 0.81 CTSK (0.33) GRIK1GRIK2CTSKHDAC2
SCHEMBL14117564 0.81 CTSK (0.33) GRIK1GRIK2CTSKHDAC2
SCHEMBL8427682 0.81 GRIK1 (0.33) MMP1MMP2MMP3MMP7GRIK1
SCHEMBL13913690 0.81 CPB2 (0.33) MMP1MMP3MMP9CTSKHDAC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7718795-B2 Succinoylamino benzodiazepines as inhibitors of aβ protein production BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2010-05-18 US disclosed
US-7507815-B2 Succinoylamino lactams as inhibitors of a-β protein production BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2009-03-24 US disclosed
US-20090069293-A1 SUCCINOYLAMINO BENZODIAZEPINES AS INHIBITORS OF AB PROTEIN PRODUCTION BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2009-03-12 US disclosed
US-20080293692-A1 SUCCINOYLAMINO LACTAMS AS INHIBITORS OF A-BETA PROTEIN PRODUCTION BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2008-11-27 US disclosed
US-7456172-B2 Succinoylamino benzodiazepines as inhibitors of Aβ protein production BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2008-11-25 US disclosed
US-20080207602-A1 SUCCINOYLAMINO BENZODIAZEPINES AS INHIBITORS OF ABETA PROTEIN PRODUCTION BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2008-08-28 US disclosed
US-7304055-B2 Succinoylamino lactams as inhibitors of Aβ protein production BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2007-12-04 US disclosed
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
US-20060122169-A1 Succinoylamino benzodiazepines as inhibitors of Abeta protein production DUPONT PHARMACEUTICALS (US) 2006-06-08 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090069293-A1 SUCCINOYLAMINO BENZODIAZEPINES AS INHIBITORS OF AB PROTEIN PRODUCTION GABRA5, APP, GABRE MMP1 4532/4885MMP2 4030/4885MMP3 4395/4885
US-20080293692-A1 SUCCINOYLAMINO LACTAMS AS INHIBITORS OF A-BETA PROTEIN PRODUCTION BACE1, APH1A, APP MMP1 3143/4885MMP2 2099/4885MMP3 3633/4885
US-20080207602-A1 SUCCINOYLAMINO BENZODIAZEPINES AS INHIBITORS OF ABETA PROTEIN PRODUCTION BACE1, APP, GABRE MMP1 4204/4885MMP2 3672/4885MMP3 4243/4885
US-20060122169-A1 Succinoylamino benzodiazepines as inhibitors of Abeta protein production BACE1, APP, GABRE MMP1 4204/4885MMP2 3672/4885MMP3 4243/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.