SCHEMBL29467737

SCHEMBL29467737

O=C(O)CC(NC(=O)CNC(=O)CCOCCOCCOCCNC(=O)C(C(C(=O)NCCOCCOCCOCCC(=O)NCC(=O)NC(CC(=O)O)C(=O)Nc1ccc(CO)cc1)N1C(=O)C=CC1=O)N1C(=O)C=CC1=O)C(=O)Nc1ccc(CO)cc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADCY6 O43306 1/20 0.34
▸ ADCY3 O60266 1/20 0.34
▸ ADCY9 O60503 1/20 0.34
▸ ADCY5 O95622 1/20 0.34
▸ ADCY8 P40145 1/20 0.34
▸ GCGR P47871 1/20 0.34
▸ ADCY7 P51828 1/20 0.34
▸ ADCY2 Q08462 1/20 0.34
▸ ADCY1 Q08828 1/20 0.34
▸ ADCY4 Q8NFM4 1/20 0.34
▸ CA12 O43570 2/20 0.32
▸ CA1 P00915 2/20 0.32
▸ CA2 P00918 2/20 0.32
▸ CA4 P22748 2/20 0.32
▸ CA9 Q16790 2/20 0.32
▸ CA14 Q9ULX7 2/20 0.32
▸ ITGB3 P05106 4/20 0.32
▸ ITGA2B P08514 2/20 0.32
▸ ITGB1 P05556 2/20 0.32
▸ ITGAV P06756 2/20 0.32

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
SCHEMBL20529422 0.76 CA1 (0.39) CA1CA2SUCNR1
SCHEMBL23961617 0.76 CA12 (0.36) ADCY6ADCY3ADCY9ADCY5ADCY8
SCHEMBL20402344 0.76 CA12 (0.36) ADCY6ADCY3ADCY9ADCY5ADCY8
SCHEMBL23961705 0.76 OPRK1 (0.37) CA12CA1CA2CA4CA9
SCHEMBL23432978 0.73 NPC1 (0.32) ADCY6ADCY3ADCY9ADCY5ADCY8
SCHEMBL23071798 0.73 MGLL (0.37) ADCY6ADCY3ADCY9ADCY5ADCY8
SCHEMBL24087858 0.73 OPRK1 (0.35) CA12CA1CA2CA4CA9
SCHEMBL23071941 0.72 CA12 (0.40) ADCY6ADCY3ADCY9ADCY5ADCY8
SCHEMBL24798443 0.71 HRH1 (0.34) CA12CA1CA2CA4CA9
SCHEMBL19026314 0.69 CA12 (0.36) ADCY6ADCY3ADCY9ADCY5ADCY8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4426727-A2 SPECIFIC CONJUGATION OF AN ANTIBODY Hangzhou Dac Biotech Co., Ltd. (CN) 2024-09-11 — — EP disclosed
WO-2022078524-A4 SPECIFIC CONJUGATION OF AN ANTIBODY HANGZHOU DAC BIOTECH CO., LTD. (CN) 2022-12-08 — — WO disclosed
WO-2022078524-A2 SPECIFIC CONJUGATION OF AN ANTIBODY HANGZHOU DAC BIOTECH CO., LTD. (CN) 2022-04-21 — — WO disclosed
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