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SCHEMBL30895569

SCHEMBL30895569

CC(C)C[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)N[C@@H](CCCNC(N)=O)C(=O)Nc1ccc(COC(=O)Oc2ccc([N+](=O)[O-])cc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 8/20 0.45
▸ CTSL P07711 3/20 0.42
▸ SIRT5 Q9NXA8 1/20 0.41
▸ GRB2 P62993 1/20 0.41
▸ HTR2A P28223 1/20 0.40
▸ MMP3 P08254 2/20 0.39
▸ SSTR3 P32745 1/20 0.39

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
SCHEMBL13410176 0.94 TGM2 (0.41) PTPN1SIRT5HTR2ASSTR3
SCHEMBL13401556 0.94 TGM2 (0.41) PTPN1SIRT5HTR2ASSTR3
SCHEMBL13830646 0.92 HTR2A (0.40) PTPN1SIRT5HTR2ASSTR3
SCHEMBL12094377 0.92 HTR2A (0.40) PTPN1SIRT5HTR2ASSTR3
SCHEMBL29414597 0.92 HTR2A (0.40) PTPN1SIRT5HTR2ASSTR3
SCHEMBL2734925 0.92 HTR2A (0.40) PTPN1SIRT5HTR2ASSTR3
SCHEMBL12944195 0.92 HTR2A (0.40) PTPN1SIRT5HTR2ASSTR3
SCHEMBL19731720 0.92 HTR2A (0.40) PTPN1SIRT5HTR2ASSTR3
SCHEMBL29579452 0.92 HTR2A (0.40) PTPN1SIRT5HTR2ASSTR3
SCHEMBL13110590 0.92 HTR2A (0.40) PTPN1SIRT5HTR2ASSTR3

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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