SCHEMBL6695947

SCHEMBL6695947

CCN(CCN)C(=O)CN

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.41
MMP1 P03956 1/20 0.34
MMP2 P08253 1/20 0.34
MMP3 P08254 1/20 0.34
MMP8 P22894 1/20 0.34
CA12 O43570 2/20 0.34
CA9 Q16790 2/20 0.34
CA1 P00915 1/20 0.34
ALDH1A1 P00352 2/20 0.31
ALDH2 P05091 1/20 0.31
AOC3 Q16853 1/20 0.31
CYP1A2 P05177 1/20 0.31
HSD17B10 Q99714 1/20 0.31
HPGD P15428 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
CA2 P00918 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
SCHEMBL1790227 0.85
SCHEMBL22271561 0.84 ALDH1A1 (0.43) LMNAMMP1MMP2MMP3MMP8
SCHEMBL15636278 0.84 LMNA (0.39) LMNAMMP1MMP2MMP3MMP8
Hydrochloric Acid SCHEMBL10677864 0.82 LMNA (0.52) LMNAMMP1MMP2MMP3MMP8
SCHEMBL23736346 0.82 LMNA (0.38) LMNAMMP1MMP2MMP3MMP8
SCHEMBL18633511 0.82 LMNA (0.48) LMNAMMP1MMP2MMP3MMP8
SCHEMBL28201517 0.79 MGLL (0.48) LMNAMMP1MMP2MMP3MMP8
Hydrochloric Acid SCHEMBL10805157 0.79 LMNA (0.35) LMNAMMP1MMP2MMP3MMP8
SCHEMBL1832755 0.78
SCHEMBL11079565 0.78

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-3519419-B1 BETA-LACTAMASE INHIBITORS NOVARTIS AG (CH) 2020-05-27 EP disclosed
US-20040186160-A1 Hexahydro-cyclohepta-pyrrole oxindole as potent kinase inhibitors SUGEN, INC. 2004-09-23 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 (1 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-20040186160-A1 Hexahydro-cyclohepta-pyrrole oxindole as potent kinase inhibitors MAP3K15, MAP3K20, MAP3K19 LMNA 4797/4885MMP1 4636/4885MMP2 3669/4885

“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.