SCHEMBL6954395

SCHEMBL6954395

CCC[C@H](C(N)=O)[C@@H](CC(C)C)C(=O)N1CCCC(C(=O)O)C1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ XPNPEP2 O43895 2/20 0.43
▸ ACE P12821 2/20 0.43
▸ LMNA P02545 1/20 0.41
▸ MMP1 P03956 3/20 0.39
▸ MMP2 P08253 3/20 0.39
▸ MMP8 P22894 3/20 0.39
▸ MMP3 P08254 2/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ PRSS1 P07477 2/20 0.38
▸ TMPRSS15 P98073 2/20 0.38
▸ APP P05067 4/20 0.37
▸ PLG P00747 1/20 0.35
▸ PLAU P00749 1/20 0.35
▸ F10 P00742 1/20 0.35
▸ GAA P10253 1/20 0.34
▸ CYP2C9 P11712 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34

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
SCHEMBL6954392 1.00 XPNPEP2 (0.43) XPNPEP2ACELMNAMMP1MMP2
SCHEMBL7068510 1.00 XPNPEP2 (0.43) XPNPEP2ACELMNAMMP1MMP2
SCHEMBL7069250 0.92 LMNA (0.50) LMNAMMP1MMP2MMP8MMP3
SCHEMBL6956637 0.92 LMNA (0.50) LMNAMMP1MMP2MMP8MMP3
SCHEMBL6956635 0.92 LMNA (0.50) LMNAMMP1MMP2MMP8MMP3
SCHEMBL7067800 0.86 ALDH1A1 (0.50) ALDH1A1SMN1; SMN2
SCHEMBL6954284 0.86 ALDH1A1 (0.50) ALDH1A1SMN1; SMN2
SCHEMBL6955027 0.86 HPGD (0.44) LMNAMMP1MMP2MMP8MMP3
SCHEMBL7065389 0.86 HPGD (0.44) LMNAMMP1MMP2MMP8MMP3
SCHEMBL6954285 0.86 ALDH1A1 (0.50) ALDH1A1SMN1; SMN2

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
US-20030232985-A1 Succinoylamino heterocycles as inhibitors of a beta protein production THOMPSON LORIN A (US) 2003-12-18 — — US disclosed
US-20030073701-A1 Succinoylamino heterocycles as inhibitors of a beta protein production BRISTOL-MYERS SQUIBB PHARMA COMPANY 2003-04-17 — — US disclosed
EP-1268454-A1 SUCCINOYLAMINO HETEROCYCLES AS INHIBITORS OF A-BETA PROTEIN PRODUCTION Bristol-Myers Squibb Pharma Company (US) 2003-01-02 — — EP disclosed
WO-2001074796-A1 SUCCINOYLAMINO HETEROCYCLES AS INHIBITORS OF Aβ PROTEIN PRODUCTION BRISTOL-MYERS SQUIBB PHARMA COMPANY (US) 2001-10-11 — — WO 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 (2 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-20030073701-A1 Succinoylamino heterocycles as inhibitors of a beta protein production APP, BACE1, APH1A XPNPEP2 682/4885ACE 406/4885LMNA 911/4885
US-20030232985-A1 Succinoylamino heterocycles as inhibitors of a beta protein production APP, BACE1, APH1A XPNPEP2 682/4885ACE 406/4885LMNA 911/4885

“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.

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