SCHEMBL393242

SCHEMBL393242

O=C(O)CNC(=O)OCOC(=O)CC1CCCCC1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.41
L3MBTL1 Q9Y468 3/20 0.39
ALDH1A1 P00352 3/20 0.38
KMT2A Q03164 2/20 0.38
EPHX1 P07099 1/20 0.38
HPGD P15428 1/20 0.38
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
EPHX2 P34913 2/20 0.36
BBOX1 O75936 1/20 0.35
ASPH Q12797 1/20 0.35
KDM8 Q8N371 1/20 0.35
EGLN1 Q9GZT9 1/20 0.35
HIF1AN Q9NWT6 1/20 0.35
TDP1 Q9NUW8 1/20 0.35

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
SCHEMBL390378 0.98 LMNA (0.39) LMNAL3MBTL1ALDH1A1KMT2AEPHX1
SCHEMBL204609 0.80 LMNA (0.54) LMNAALDH1A1EPHX1BBOX1ASPH
SCHEMBL392016 0.79 ALDH1A1 (0.38) L3MBTL1ALDH1A1KMT2AEPHX1BBOX1
SCHEMBL390786 0.78 ADRB2 (0.37) L3MBTL1ALDH1A1KMT2AHPGDBBOX1
SCHEMBL6137896 0.74 RAB9A (0.56) KMT2AEPHX1HPGDNPC1RAB9A
SCHEMBL392299 0.74 ATM (0.38) L3MBTL1ALDH1A1KMT2AHPGDEGLN1
SCHEMBL393503 0.73 ALDH1A1 (0.37) LMNAL3MBTL1ALDH1A1KMT2AHPGD
SCHEMBL17928598 0.73 L3MBTL1 (0.43) LMNAL3MBTL1ALDH1A1KMT2AEPHX1
SCHEMBL13546279 0.72 RAB9A (0.53) ALDH1A1KMT2AEPHX1HPGDNPC1
SCHEMBL13618451 0.71 L3MBTL1 (0.44) LMNAL3MBTL1ALDH1A1KMT2AEPHX1

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-8101590-B2 9-aminocarbonylsubstituted derivatives of glycylcyclines WYETH LLC (US) 2012-01-24 US disclosed
US-20070049564-A1 9-Aminocarbonylsubstituted derivatives of glycylcyclines WYETH (US) 2007-03-01 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-20070049564-A1 9-Aminocarbonylsubstituted derivatives of glycylcyclines Q6ZSR9, GMPS, RPS10 LMNA 2954/4885L3MBTL1 3336/4885ALDH1A1 1826/4885

“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.