SCHEMBL21275962

SCHEMBL21275962

CC(C)C(C)C(=O)OCc1ccc(NC(=O)[C@@H](C)NC(=O)[C@@H](C)NC(=O)CCOCCOCCOCCOCCNC(=O)CCN2C(=O)C=CC2=O)cc1

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 2/20 0.33
▸ CA1 P00915 2/20 0.33
▸ CA2 P00918 2/20 0.33
▸ CA4 P22748 2/20 0.33
▸ CA9 Q16790 2/20 0.33
▸ CA14 Q9ULX7 2/20 0.33
▸ NPC1 O15118 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ NR3C1 P04150 1/20 0.32
▸ OPRK1 P41145 2/20 0.31
▸ MEN1 O00255 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ EPOR P19235 2/20 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
SCHEMBL21008369 1.00 CA12 (0.33) CA12CA1CA2CA4CA9
SCHEMBL24781307 0.95 NR3C1 (0.35) CA12CA1CA2CA4CA9
SCHEMBL18909059 0.94 CA12 (0.34) CA12CA1CA2CA4CA9
SCHEMBL23789199 0.94 CA12 (0.34) CA12CA1CA2CA4CA9
SCHEMBL19705582 0.92 CA12 (0.34) CA12CA1CA2CA4CA9
SCHEMBL17815411 0.92 CA12 (0.34) CA12CA1CA2CA4CA9
SCHEMBL17722949 0.92 CA12 (0.34) CA12CA1CA2CA4CA9
SCHEMBL22910463 0.91 NR3C1 (0.35) CA12CA1CA2CA4CA9
SCHEMBL19503143 0.91 CA12 (0.33) CA12CA1CA2CA4CA9
SCHEMBL22314188 0.91 CA12 (0.33) CA12CA1CA2CA4CA9

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-10383948-B2 Anti-cMet antibody drug conjugates and methods for their use ABBVIE INC. (US) 2019-08-20 — — 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-10383948-B2 Anti-cMet antibody drug conjugates and methods for their use MMAB, HNMT, SHMT1 CA12 585/4885CA1 3116/4885CA2 3717/4885

“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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