SCHEMBL29159983

SCHEMBL29159983

N#Cc1ccc(C(O)c2cc(O)cc(Cl)n2)c(F)c1

nearest known ligand 0.34

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ FNTA P49354 1/20 0.32
▸ FNTB P49356 1/20 0.32
▸ S1PR3 Q99500 3/20 0.32
▸ S1PR4 O95977 1/20 0.32
▸ S1PR1 P21453 1/20 0.32
▸ CYP11B1 P15538 2/20 0.32
▸ CYP19A1 P11511 2/20 0.32
▸ HSD17B14 Q9BPX1 1/20 0.32
▸ CTSA P10619 1/20 0.31
▸ CA12 O43570 1/20 0.31
▸ CA2 P00918 1/20 0.31
▸ CA3 P07451 1/20 0.31
▸ CA6 P23280 1/20 0.31
▸ CA9 Q16790 1/20 0.31
▸ CA14 Q9ULX7 1/20 0.31
▸ CYP11B2 P19099 1/20 0.30
▸ BRD4 O60885 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
SCHEMBL28786609 0.83 L3MBTL1 (0.39) FNTAFNTBS1PR3S1PR4S1PR1
SCHEMBL28754383 0.77 EGLN2 (0.35) S1PR3S1PR4S1PR1CTSA
SCHEMBL28754410 0.75 EGLN2 (0.37) CTSA
SCHEMBL22391829 0.73 PKM (0.34) FNTAFNTBCTSA
SCHEMBL29159885 0.71 S1PR3 (0.34) S1PR3S1PR4S1PR1CTSA
SCHEMBL24958707 0.68 GRM5 (0.46) CYP19A1
SCHEMBL29098018 0.68 PDE2A (0.39) CYP11B1CA12CA2CA3CA6
SCHEMBL30200169 0.68 PDE2A (0.39) CYP11B1CA12CA2CA3CA6
SCHEMBL29098016 0.68 PDE2A (0.39) CYP11B1CA12CA2CA3CA6
SCHEMBL29098047 0.68 PDE2A (0.39) CYP11B1CA12CA2CA3CA6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117295729-A Carboxy-benzimidazole GLP-1R modulating compounds 吉利德科学公司 2023-12-26 — — CN disclosed
CN-117279905-A Carboxy-benzimidazole GLP-1R modulating compounds 吉利德科学公司 2023-12-22 — — CN disclosed
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