SCHEMBL25633003

SCHEMBL25633003

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

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MME P08473 3/20 0.61
MMP2 P08253 9/20 0.45
MMP9 P14780 7/20 0.45
MMP1 P03956 6/20 0.45
MMP3 P08254 3/20 0.45
CACNA2D1 P54289 2/20 0.45
CACNB3 P54284 1/20 0.45
CACNA1C Q13936 1/20 0.45
PGR P06401 1/20 0.45
ADRA1A P35348 1/20 0.45
HTR2B P41595 1/20 0.45
CACNA2D2 Q9NY47 1/20 0.45
MMP8 P22894 6/20 0.44
FCER2 P06734 2/20 0.41
MMP7 P09237 3/20 0.40
MMP12 P39900 1/20 0.40
MMP13 P45452 1/20 0.40
BMP1 P13497 1/20 0.38

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
SCHEMBL24141313 0.81 CACNA2D1 (0.38) MMECACNA2D1CACNB3CACNA1CPGR
SCHEMBL23346343 0.81 CACNA2D1 (0.38) MMECACNA2D1CACNB3CACNA1CPGR
SCHEMBL19825789 0.79 MME (0.38) MMEMMP2MMP9MMP1MMP3
SCHEMBL26672708 0.79 MME (0.38) MMEMMP2MMP9MMP1MMP3
SCHEMBL7368385 0.79 MME (0.81) MMEMMP2MMP9MMP1MMP3
SCHEMBL25633002 0.79 MME (0.63) MMEMMP2MMP9MMP1CACNA2D1
SCHEMBL23805327 0.78 CACNA2D1 (0.36) MMECACNA2D1CACNB3CACNA1CPGR
SCHEMBL21564122 0.78 CACNA2D1 (0.36) MMECACNA2D1CACNB3CACNA1CPGR
SCHEMBL21994104 0.77 MME (0.67) MMEMMP2MMP9MMP1MMP3
SCHEMBL25633017 0.76 MME (0.51) MMEMMP2MMP9MMP1MMP3

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 4628/4885MMP2 4243/4885MMP9 3830/4885

“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.