SCHEMBL27010013

SCHEMBL27010013

CCCN(CCCC(C)=O)C(C)C

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FDPS P14324 1/20 0.36
PAOX Q6QHF9 3/20 0.36
ALDH1A1 P00352 4/20 0.35
ACHE P22303 1/20 0.34
CES1 P23141 2/20 0.31
HPGD P15428 1/20 0.31
MMP1 P03956 1/20 0.31
MMP2 P08253 1/20 0.31
MMP3 P08254 1/20 0.31
MMP8 P22894 1/20 0.31
CA12 O43570 1/20 0.30
CA2 P00918 1/20 0.30
CA9 Q16790 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
LMNA P02545 1/20 0.30
SLC15A2 Q16348 1/20 0.30
CES2 O00748 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
SCHEMBL27010008 0.88 PAOX (0.42) FDPSPAOXALDH1A1ACHETDP1
SCHEMBL24267559 0.80 FDPS (0.32) FDPS
SCHEMBL25134940 0.77 ALDH1A1 (0.39) FDPSPAOXALDH1A1TDP1LMNA
SCHEMBL23743650 0.77 FDPS (0.40) FDPSALDH1A1CA12CA2CA9
SCHEMBL865701 0.75 FDPS (0.36) FDPSALDH1A1MMP1MMP2MMP3
SCHEMBL3187223 0.75 FFAR3 (0.44) FDPSALDH1A1TDP1
SCHEMBL1686729 0.75 FDPS (0.42) FDPSCA12CA2CA9
SCHEMBL20203579 0.74 ALDH1A1 (0.39) FDPSALDH1A1LMNA
SCHEMBL23299264 0.73 FDPS (0.38) FDPSALDH1A1HPGDCA12CA2
SCHEMBL25772087 0.73 FDPS (0.38) FDPSPAOXALDH1A1HPGDCA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240018118-A1 TRICYCLIC COMPOUNDS TO DEGRADE NEOSUBSTRATES FOR MEDICAL THERAPY C 4 Therapeutics, Inc. (US) 2024-01-18 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-20240018118-A1 TRICYCLIC COMPOUNDS TO DEGRADE NEOSUBSTRATES FOR MEDICAL THERAPY NFATC1, CTSS, MMP12 FDPS 785/4885PAOX 501/4885ALDH1A1 2267/4885

“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.