SCHEMBL25633002

SCHEMBL25633002

CC(C)CC(CC(=O)NC(CN)C(=O)C(C)C)C(=O)O

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MME P08473 4/20 0.63
SLC1A3 P43003 1/20 0.41
SLC1A2 P43004 1/20 0.41
MMP2 P08253 2/20 0.38
MMP9 P14780 2/20 0.38
MMP8 P22894 1/20 0.38
MMP7 P09237 1/20 0.38
MMP12 P39900 1/20 0.38
MMP13 P45452 1/20 0.38
CACNA2D1 P54289 2/20 0.38
ALDH1A1 P00352 2/20 0.38
CACNB3 P54284 1/20 0.38
CACNA1C Q13936 1/20 0.38
PGR P06401 1/20 0.38
ADRA1A P35348 1/20 0.38
HTR2B P41595 1/20 0.38
CACNA2D2 Q9NY47 1/20 0.38
ACE P12821 1/20 0.37
MMP1 P03956 1/20 0.36
FCER2 P06734 1/20 0.36

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
SCHEMBL25633192 0.86 MME (0.65) MMESLC1A3SLC1A2MMP2MMP9
SCHEMBL23346342 0.81 GABRR1 (0.38) MMECACNA2D1ALDH1A1CACNB3CACNA1C
SCHEMBL25633003 0.79 MME (0.61) MMEMMP2MMP9MMP8MMP7
SCHEMBL26852942 0.77 MME (0.36) MMEACE
SCHEMBL26852933 0.77 MME (0.36) MMEACE
SCHEMBL20628537 0.77 MME (0.69) MMESLC1A3SLC1A2MMP2MMP9
SCHEMBL8269110 0.71 MME (0.61) MMESLC1A3SLC1A2MMP2MMP9
SCHEMBL19825789 0.71 MME (0.38) MMEMMP2MMP9MMP8MMP7
SCHEMBL26672708 0.71 MME (0.38) MMEMMP2MMP9MMP8MMP7
SCHEMBL23658204 0.71 CACNA2D1 (0.43) CACNA2D1CACNB3CACNA1CPGRADRA1A

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 MME 4628/4885SLC1A3 80/4885SLC1A2 231/4885

“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.