SCHEMBL30442239

SCHEMBL30442239

CC(C)(O)CN1CC2CCC(C1)N2Cc1ccc(-c2cc3c(cn2)cc(-c2ccc(S(C)(=O)=O)cc2)n3C2CC2)cc1

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 13/20 0.42
▸ PTGS2 P35354 3/20 0.38
▸ KDR P35968 1/20 0.35
▸ MAPK14 Q16539 1/20 0.35
▸ STAT3 P40763 1/20 0.34
▸ PIK3CA P42336 1/20 0.33
▸ MTOR P42345 1/20 0.33
▸ TGFBR1 P36897 1/20 0.33

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
SCHEMBL26072673 1.00 GPR119 (0.42) GPR119PTGS2KDRMAPK14STAT3
SCHEMBL26072118 0.94 GPR119 (0.42) GPR119PTGS2KDRMAPK14STAT3
SCHEMBL29396269 0.94 GPR119 (0.42) GPR119PTGS2KDRMAPK14STAT3
SCHEMBL26072716 0.91 GPR119 (0.43) GPR119PTGS2STAT3
SCHEMBL29395748 0.91 GPR119 (0.43) GPR119PTGS2STAT3
SCHEMBL26072047 0.85 GPR119 (0.45) GPR119STAT3
SCHEMBL31576220 0.85 GPR119 (0.45) GPR119STAT3
SCHEMBL31576213 0.77 CCR2 (0.38) PTGS2STAT3
SCHEMBL26072351 0.77 CCR2 (0.38) PTGS2STAT3
SCHEMBL31576221 0.76 GPR119 (0.44) GPR119PTGS2KDRMAPK14PIK3CA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4200298-B1 1H-PYRROLO[3,2-C]PYRIDINE AND 1H-PYRROLO[2,3-C]PYRIDINE DERIVATIVES AS TLR9 INHIBITORS FOR THE TREATMENT OF FIBROSIS BRISTOL MYERS SQUIBB CO (US) 2025-05-21 — — EP claimed
CN-115867549-A 1H-pyrrolo [3,2-c ] pyridine and 1H-pyrrolo [2,3-c ] pyridine derivatives as TLR9 inhibitors for the treatment of fibrosis 百时美施贵宝公司 2023-03-28 — — CN claimed
CN-115867549-A 1H-pyrrolo [3,2-c ] pyridine and 1H-pyrrolo [2,3-c ] pyridine derivatives as TLR9 inhibitors for the treatment of fibrosis 百时美施贵宝公司 2023-03-28 — — CN disclosed
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