SCHEMBL24756979

SCHEMBL24756979

CNC(C)(C)C(=O)N[C@@H](CCCCNC(=O)C(C)CCO)C(N)=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TLR2 O60603 1/20 0.40
▸ SIRT5 Q9NXA8 3/20 0.37
▸ SIRT6 Q8N6T7 1/20 0.35
▸ SIRT1 Q96EB6 1/20 0.35
▸ ALB P02768 1/20 0.34
▸ NMT2 O60551 1/20 0.33
▸ NMT1 P30419 1/20 0.33
▸ PTPN2 P17706 2/20 0.33
▸ PTPN1 P18031 2/20 0.33
▸ PTGS1 P23219 1/20 0.33
▸ KCNH2 Q12809 1/20 0.33
▸ CNR1 P21554 1/20 0.32
▸ GRIA1 P42261 1/20 0.31
▸ DPP7 Q9UHL4 1/20 0.31
▸ SIRT2 Q8IXJ6 2/20 0.31
▸ NOD1 Q9Y239 1/20 0.31
▸ GNAI3 P08754 1/20 0.30
▸ GNAO1 P09471 1/20 0.30
▸ GNAI1 P63096 1/20 0.30
▸ CA1 P00915 1/20 0.30

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
SCHEMBL2742864 0.77 NPY4R (0.38) TLR2SIRT5ALB
SCHEMBL25148125 0.73 C3AR1 (0.35) SIRT5SIRT6SIRT1ALB
SCHEMBL16299579 0.73 NOD1 (0.32) SIRT5NOD1
SCHEMBL12157383 0.71 SIRT6 (0.47) TLR2SIRT5SIRT6SIRT1ALB
SCHEMBL16283873 0.69 NOD1 (0.47) TLR2SIRT5SIRT6SIRT1ALB
SCHEMBL24220334 0.69 GRIA1 (0.42) TLR2SIRT5SIRT6SIRT1ALB
SCHEMBL24826060 0.69 GRIA1 (0.40) TLR2SIRT5SIRT6SIRT1ALB
SCHEMBL20887854 0.69 TLR2 (0.44) TLR2SIRT5SIRT6SIRT1PTPN2
SCHEMBL22876028 0.68 DPP7 (0.49) DPP7NOD1GNAI3GNAO1GNAI1
SCHEMBL24308138 0.68 SIRT6 (0.41) TLR2SIRT5SIRT6SIRT1ALB

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-2022266068-A2 GLP-1 RECEPTOR AGONISTS HAVING IMPROVED PHARMACOLOGICAL AND DRUG DELIVERY PROPERTIES RESOLUTE BIO, INC. (US) 2022-12-22 — — WO disclosed
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