SCHEMBL12694367

SCHEMBL12694367

COC(=O)NC(CCCCNC(C)=O)C(=O)ON1C(=O)CCC1=O

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ FOLH1 Q04609 2/20 0.39
▸ SIRT1 Q96EB6 3/20 0.35
▸ SIRT6 Q8N6T7 1/20 0.35
▸ SIRT5 Q9NXA8 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ HIF1A Q16665 1/20 0.35
▸ SIRT2 Q8IXJ6 1/20 0.35
▸ SIRT3 Q9NTG7 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ TGM2 P21980 2/20 0.33
▸ CA1 P00915 3/20 0.32
▸ CA2 P00918 3/20 0.32
▸ ALB P02768 3/20 0.32
▸ KLK7 P49862 1/20 0.32
▸ KLK5 Q9Y337 1/20 0.32
▸ ATM Q13315 1/20 0.32
▸ TDP1 Q9NUW8 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
SCHEMBL327848 0.93 EPHX1 (0.38) FOLH1SIRT1SIRT2SIRT3TGM2
SCHEMBL10017795 0.93 EPHX1 (0.38) FOLH1SIRT1SIRT2SIRT3TGM2
SCHEMBL10328000 0.93 FOLH1 (0.42) FOLH1SIRT1SIRT6SIRT5KDM4E
SCHEMBL12509746 0.92 SIRT1 (0.38) FOLH1SIRT1SIRT6SIRT5SIRT2
SCHEMBL12508324 0.89 EPHX1 (0.36) SIRT1SIRT2SIRT3SMN1; SMN2TGM2
SCHEMBL13167106 0.88 ACE (0.36) FOLH1SIRT1SIRT2SIRT3TGM2
SCHEMBL13901992 0.86 SIRT6 (0.46) FOLH1SIRT1SIRT6SIRT5KDM4E
SCHEMBL12508619 0.85 SIRT2 (0.31) SIRT1SIRT2SIRT3
SCHEMBL2756775 0.84 SIRT2 (0.36) FOLH1SIRT1SIRT2SIRT3TGM2
SCHEMBL277624 0.83 SIRT2 (0.38) FOLH1SIRT1SIRT2SIRT3TGM2

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-20120245289-A1 POLYMER-FACTOR VIII MOIETY CONJUGATES NEKTAR THERAPEUTICS (US) 2012-09-27 — — US disclosed
US-20070105809-A1 Modulators of coagulation factors with enhanced stability REGADO BIOSCIENCES, INC. 2007-05-10 — — 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 (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-20120245289-A1 POLYMER-FACTOR VIII MOIETY CONJUGATES F8, F9, F13B FOLH1 220/4885SIRT1 4382/4885SIRT6 3095/4885
US-20070105809-A1 Modulators of coagulation factors with enhanced stability SERPINC1, TFPI, F13B FOLH1 1442/4885SIRT1 1729/4885SIRT6 1258/4885

“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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