SCHEMBL29159855

SCHEMBL29159855

CCOC(=O)c1csc(C(O)c2cccc(Br)n2)n1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 8/20 0.48
▸ NPC1 O15118 6/20 0.48
▸ MAPT P10636 6/20 0.48
▸ POLB P06746 1/20 0.48
▸ PKM P14618 1/20 0.48
▸ NPSR1 Q6W5P4 1/20 0.48
▸ RXFP1 Q9HBX9 1/20 0.48
▸ ALDH1A1 P00352 2/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ CYP1A2 P05177 2/20 0.46
▸ TDP1 Q9NUW8 1/20 0.45
▸ SMN1; SMN2 Q16637 4/20 0.44
▸ CYP2C19 P33261 1/20 0.43
▸ ABCB1 P08183 2/20 0.42
▸ HSP90AA1 P07900 2/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ GAA P10253 3/20 0.41
▸ CCR3 P51677 1/20 0.41
▸ LMNA P02545 1/20 0.40

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
SCHEMBL29159767 0.81 HDAC1 (0.41) ALDH1A1TDP1L3MBTL1
SCHEMBL29159988 0.80 TLR7 (0.43) RAB9ANPC1POLBALDH1A1GAA
SCHEMBL2440072 0.77 RAB9A (0.60) RAB9ANPC1MAPTPOLBPKM
SCHEMBL12548274 0.76 RAB9A (0.59) RAB9ANPC1MAPTPOLBPKM
SCHEMBL4740289 0.75 EGFR (0.53) RAB9ANPC1MAPTPOLBPKM
SCHEMBL10322640 0.74 MMP8 (0.45) NPC1MAPTPOLBNPSR1ALDH1A1
SCHEMBL198054 0.74 CYP1A2 (0.77) RAB9ANPC1MAPTPOLBPKM
SCHEMBL29911292 0.74 CYP1A2 (0.77) RAB9ANPC1MAPTPOLBPKM
SCHEMBL29159856 0.73 MAPT (0.62) RAB9ANPC1MAPTPOLBPKM
SCHEMBL15111192 0.73 RAB9A (0.59) RAB9ANPC1MAPTPOLBPKM

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