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SCHEMBL23652015

SCHEMBL23652015

CCC(C)C(C(CC(=O)N1CCCC1C(OC)C(C)C(=O)NC(Cc1ccccc1)C(=O)NCCS(=O)(=O)O)OC)N(C)C(=O)[C@@H](NC(=O)CN(C)C(C)C)C(C)C

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 1/20 0.41
▸ SSTR2 P30874 2/20 0.39
▸ REN P00797 2/20 0.36
▸ FOLH1 Q04609 3/20 0.35
▸ TTR P02766 2/20 0.35
▸ CTSD P07339 6/20 0.35
▸ CTSE P14091 4/20 0.35
▸ BACE1 P56817 2/20 0.35

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
SCHEMBL13838248 0.93 CYP3A4 (0.41) CYP3A4SSTR2RENFOLH1TTR
SCHEMBL3266288 0.93 CYP3A4 (0.41) CYP3A4SSTR2RENFOLH1TTR
SCHEMBL19372571 0.92 CYP3A4 (0.42) CYP3A4SSTR2RENFOLH1TTR
SCHEMBL13034951 0.92 CYP3A4 (0.42) CYP3A4SSTR2RENFOLH1TTR
SCHEMBL15047596 0.92 CYP3A4 (0.43) CYP3A4SSTR2RENFOLH1TTR
SCHEMBL1687443 0.92 CYP3A4 (0.43) CYP3A4SSTR2RENFOLH1TTR
SCHEMBL20684299 0.92 CYP3A4 (0.43) CYP3A4SSTR2RENFOLH1TTR
SCHEMBL19490727 0.92 CYP3A4 (0.42) CYP3A4SSTR2RENFOLH1TTR
SCHEMBL2734904 0.92 CYP3A4 (0.42) CYP3A4SSTR2RENFOLH1TTR
SCHEMBL12571933 0.91 CYP3A4 (0.40) CYP3A4SSTR2RENFOLH1TTR

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
EP-3409287-B9 ANTIBODY DRUG CONJUGATES (ADC) THAT BIND TO 191P4D12 PROTEINS AGENSYS INC (US) 2021-07-21 — — EP disclosed