SCHEMBL30895514

SCHEMBL30895514

CC(C)(C)OC(=O)N[C@@H](CCCCNC(=O)CCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCN=[N+]=[N-])C(=O)O

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ALB P02768 8/20 0.43
▸ CAPN1 P07384 1/20 0.41
▸ GLP1R P43220 8/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ TSHR P16473 1/20 0.41
▸ MEN1 O00255 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ CTSS P25774 1/20 0.38
▸ CTSK P43235 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
SCHEMBL29796125 0.90 CAPN1 (0.46) ALBCAPN1ALDH1A1TSHRMEN1
SCHEMBL15498945 0.89 CAPN1 (0.47) ALBCAPN1GLP1RALDH1A1TSHR
SCHEMBL21602728 0.87 CAPN1 (0.46) ALBCAPN1GLP1RALDH1A1TSHR
SCHEMBL21713193 0.86 CAPN1 (0.46) ALBCAPN1GLP1RALDH1A1TSHR
SCHEMBL31045346 0.86 CAPN1 (0.46) ALBCAPN1GLP1RALDH1A1TSHR
SCHEMBL24630340 0.86 GLP1R (0.49) ALBGLP1R
SCHEMBL29072106 0.86 GLP1R (0.49) ALBGLP1R
SCHEMBL21713192 0.86 CAPN1 (0.46) ALBCAPN1GLP1RALDH1A1TSHR
SCHEMBL27150954 0.86 CAPN1 (0.46) ALBCAPN1GLP1RALDH1A1TSHR
SCHEMBL27145930 0.86 CAPN1 (0.46) ALBCAPN1GLP1RALDH1A1TSHR

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4608451-A1 CD70 ANTIBODY DRUG CONJUGATES AND METHODS OF USING THE SAME Genmab A/S (DK) 2025-09-03 — — EP disclosed
WO-2024092067-A1 CD70 ANTIBODY DRUG CONJUGATES AND METHODS OF USING THE SAME PROFOUNDBIO US CO. (US) 2024-05-02 — — WO disclosed
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