SCHEMBL24123041

SCHEMBL24123041

CC(C)C(C)Cc1nc2ccccc2s1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ UBE2T Q9NPD8 1/20 0.56
▸ ASIC3 Q9UHC3 1/20 0.56
▸ LOXL2 Q9Y4K0 1/20 0.53
▸ HPGD P15428 4/20 0.49
▸ CYP1A2 P05177 1/20 0.49
▸ CYP2C19 P33261 1/20 0.49
▸ SMN1; SMN2 Q16637 7/20 0.49
▸ RAB9A P51151 6/20 0.49
▸ NPC1 O15118 5/20 0.49
▸ MAPK1 P28482 1/20 0.49
▸ L3MBTL1 Q9Y468 1/20 0.49
▸ MAPT P10636 4/20 0.48
▸ KMT2A Q03164 4/20 0.48
▸ PKM P14618 1/20 0.48
▸ ALOX15 P16050 1/20 0.45
▸ HTT P42858 1/20 0.45
▸ PDE10A Q9Y233 1/20 0.45
▸ MEN1 O00255 2/20 0.44
▸ KDM4E B2RXH2 1/20 0.44
▸ GAA P10253 1/20 0.44

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
SCHEMBL29023737 0.87 UBE2T (0.53) UBE2TASIC3LOXL2HPGDCYP1A2
SCHEMBL2662248 0.86 UBE2T (0.59) UBE2TASIC3LOXL2HPGDCYP1A2
SCHEMBL30036322 0.83 UBE2T (0.53) UBE2TASIC3LOXL2HPGDCYP1A2
SCHEMBL14478202 0.83 UBE2T (0.61) UBE2TASIC3LOXL2HPGDCYP1A2
SCHEMBL12213527 0.83 UBE2T (0.56) UBE2TASIC3LOXL2HPGDCYP1A2
SCHEMBL29690519 0.83 UBE2T (0.56) UBE2TASIC3LOXL2HPGDCYP1A2
SCHEMBL14478204 0.83 UBE2T (0.61) UBE2TASIC3LOXL2HPGDCYP1A2
SCHEMBL24691386 0.80 UBE2T (0.53) UBE2TASIC3LOXL2HPGDCYP1A2
SCHEMBL29278085 0.78 CYP1A2 (0.51) UBE2TASIC3LOXL2HPGDCYP1A2
SCHEMBL29023729 0.78 UBE2T (0.50) UBE2TASIC3LOXL2HPGDCYP1A2

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-20210393809-A1 LABELED INHIBITORS OF PROSTATE SPECIFIC MEMBRANE ANTIGEN (PSMA), THEIR USE AS IMAGING AGENTS AND PHARMACEUTICAL AGENTS FOR THE TREATMENT OF PSMA-EXPRESSING CANCERS Universität Heidelbert (DE) 2021-12-23 — — 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-20210393809-A1 LABELED INHIBITORS OF PROSTATE SPECIFIC MEMBRANE ANTIGEN (PSMA), THEIR USE AS IMAGING AGENTS AND PHARMACEUTICAL AGENTS FOR THE TREATMENT OF PSMA-EXPRESSING CANCERS KLK3, PSMA3, FOLH1 UBE2T 752/4885ASIC3 326/4885LOXL2 351/4885

“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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