SCHEMBL20133522

SCHEMBL20133522

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nearest known ligand 0.65

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.65
SLCO1B1 Q9Y6L6 1/20 0.65
LMNA P02545 2/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
TDP1 Q9NUW8 1/20 0.48
PDE4A P27815 1/20 0.46
KDM4E B2RXH2 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.33
NOS2 P35228 2/20 0.32
TOP1 P11387 1/20 0.31
PAX8 Q06710 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
SCHEMBL107892 1.00 USP2 (0.65) USP2SLCO1B1LMNAL3MBTL1TDP1
SCHEMBL4330349 1.00 USP2 (0.65) USP2SLCO1B1LMNAL3MBTL1TDP1
SCHEMBL5658566 0.89 USP2 (0.53) USP2SLCO1B1LMNAL3MBTL1TDP1
SCHEMBL11274631 0.83
SCHEMBL28914 0.83 USP2 (0.61) USP2SLCO1B1LMNAL3MBTL1TDP1
SCHEMBL21057 0.83 USP2 (0.61) USP2SLCO1B1LMNAL3MBTL1TDP1
SCHEMBL28138343 0.83 USP2 (0.61) USP2SLCO1B1LMNAL3MBTL1TDP1
SCHEMBL149462 0.83 USP2 (0.61) USP2SLCO1B1LMNAL3MBTL1TDP1
SCHEMBL22180508 0.82 USP2 (0.48) USP2SLCO1B1LMNAL3MBTL1TDP1
Water SCHEMBL3908933 0.81 USP2 (0.59) USP2SLCO1B1LMNAL3MBTL1TDP1

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-20180125992-A1 DRUG DELIVERY CONJUGATES OF TERTIARY AMINE CONTAINING DRUGS ENDOCYTE, INC. 2018-05-10 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-20180125992-A1 DRUG DELIVERY CONJUGATES OF TERTIARY AMINE CONTAINING DRUGS ABCB11, SLC10A1, ABCB1 USP2 1601/4885SLCO1B1 32/4885LMNA 2491/4885

“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.