SCHEMBL31039856

SCHEMBL31039856

CCOC(=O)[C@H](CCCCNC(=O)OCCCCl)NC(=O)OCCCCl

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ACHE P22303 14/20 0.44
▸ KMT2A Q03164 2/20 0.39
▸ POLB P06746 1/20 0.39
▸ SIRT2 Q8IXJ6 1/20 0.39
▸ SIRT1 Q96EB6 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
SCHEMBL17411229 1.00 ACHE (0.44) ACHEKMT2APOLBSIRT2SIRT1
SCHEMBL25176590 0.87 KMT2A (0.45) ACHEKMT2APOLBSIRT2SIRT1
SCHEMBL25176589 0.87 KMT2A (0.45) ACHEKMT2APOLBSIRT2SIRT1
SCHEMBL18532377 0.87 ACHE (0.44) ACHESIRT2SIRT1
SCHEMBL13148035 0.87 ACHE (0.59) ACHESIRT2SIRT1
SCHEMBL3699964 0.87 ACHE (0.59) ACHESIRT2SIRT1
SCHEMBL3695872 0.87 ACHE (0.59) ACHESIRT2SIRT1
SCHEMBL18532442 0.87 ACHE (0.44) ACHESIRT2SIRT1
SCHEMBL16013924 0.85 FOLH1 (0.46) ACHESIRT2SIRT1
SCHEMBL17411320 0.84 ACHE (0.41) ACHEKMT2APOLBSIRT2SIRT1

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-2964224-B1 POLYMER CONJUGATE FOR DELIVERY OF A BIOACTIVE AGENT POLYACTIVA PTY LTD (AU) 2024-07-03 — — EP disclosed
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