SCHEMBL25633095

SCHEMBL25633095

CCC(CC(C)C(=O)O)NC(C)=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAALAD2 Q9Y3Q0 3/20 0.47
FOLH1 Q04609 2/20 0.47
ALDH1A1 P00352 2/20 0.47
KDM4E B2RXH2 1/20 0.39
MAPT P10636 1/20 0.39
THRB P10828 1/20 0.39
ALOX15 P16050 1/20 0.39
NFKB1 P19838 1/20 0.39
PTGS2 P35354 1/20 0.39
THPO P40225 1/20 0.39
RECQL P46063 1/20 0.39
BLM P54132 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ENPEP Q07075 2/20 0.38
MME P08473 3/20 0.38
ACE P12821 2/20 0.38
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
MMP1 P03956 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
SCHEMBL8494977 0.79 NAALAD2 (0.45) NAALAD2FOLH1ENPEPMMEACE
SCHEMBL21195111 0.78 SLC1A1 (0.52) ALDH1A1
SCHEMBL422585 0.78
SCHEMBL22278772 0.77 NAALAD2 (0.52) NAALAD2FOLH1ALDH1A1KDM4EMAPT
SCHEMBL4801958 0.75 CTSK (0.46) NAALAD2FOLH1CA1CA2
SCHEMBL14049211 0.75 PLA2G10 (0.56) ALDH1A1SMN1; SMN2
SCHEMBL3587007 0.74 NAALAD2 (0.41) NAALAD2FOLH1ALDH1A1MAPTBLM
SCHEMBL16283422 0.74 MME (0.64) MMEACEMMEL1
SCHEMBL1144276 0.72 CRAT (0.41) ALDH1A1KDM4EMAPTTHRBALOX15
SCHEMBL7731906 0.72 CRAT (0.41) ALDH1A1KDM4EMAPTTHRBALOX15

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-20230173093-A1 CHARGE VARIANT LINKERS SEAGEN INC (US) 2023-06-08 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-20230173093-A1 CHARGE VARIANT LINKERS SSB, UACA, CDA NAALAD2 772/4885FOLH1 160/4885ALDH1A1 1439/4885

“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.