SCHEMBL24642903

SCHEMBL24642903

CCCCN(CCCC)CCCC[C@H](NC(=O)[C@@H](NO)C(C)C)C(=O)NCC(=O)NCO

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ SIRT2 Q8IXJ6 2/20 0.34
▸ BIRC2 Q13490 4/20 0.34
▸ FURIN P09958 5/20 0.33
▸ SIRT1 Q96EB6 2/20 0.33
▸ SIRT6 Q8N6T7 1/20 0.33
▸ KMT2A Q03164 1/20 0.32
▸ PRSS1 P07477 2/20 0.32
▸ NMT2 O60551 1/20 0.32
▸ NMT1 P30419 1/20 0.32
▸ SIRT3 Q9NTG7 1/20 0.32
▸ CTSL P07711 1/20 0.31
▸ TLR2 O60603 1/20 0.31

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
SCHEMBL24642686 0.89 ECE1 (0.36) SIRT2BIRC2FURINSIRT1SIRT6
SCHEMBL26499410 0.89 SIRT1 (0.37) SIRT2BIRC2FURINSIRT1SIRT6
SCHEMBL24642327 0.88 SIRT2 (0.34) SIRT2BIRC2FURINSIRT1SIRT6
SCHEMBL24642579 0.88 SIRT1 (0.34) SIRT2BIRC2FURINSIRT1SIRT6
SCHEMBL24642902 0.87 NMT2 (0.33) FURINNMT2NMT1
SCHEMBL24642922 0.84 SIRT1 (0.34) SIRT2BIRC2FURINSIRT1SIRT6
SCHEMBL24642304 0.84 ECE1 (0.36) SIRT2FURINSIRT1SIRT6PRSS1
SCHEMBL24642472 0.83 SIRT1 (0.32) SIRT2BIRC2FURINSIRT1SIRT6
SCHEMBL24642332 0.82 NMT1 (0.46) FURINSIRT1SIRT6PRSS1NMT2
SCHEMBL26542866 0.82 SIRT2 (0.33) SIRT2FURINSIRT1SIRT6PRSS1

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
WO-2022170971-A1 BIOACTIVE SUBSTANCE CONJUGATE, PREPARATION METHOD THEREFOR AND USE THEREOF 苏州宜联生物医药有限公司 2022-08-18 — — WO disclosed
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