SCHEMBL29395748

SCHEMBL29395748

CC(C)(O)CN1CCN(Cc2ccc(-c3cc4c(cn3)cc(-c3ccc(S(C)(=O)=O)cc3)n4C3CC3)cc2)CC1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ GPR119 Q8TDV5 9/20 0.43
▸ STAT3 P40763 1/20 0.41
▸ PTGS2 P35354 1/20 0.38
▸ JAK2 O60674 3/20 0.38
▸ JAK3 P52333 3/20 0.38
▸ PTK2 Q05397 3/20 0.38
▸ TNF P01375 1/20 0.38
▸ CCR2 P41597 4/20 0.36
▸ CTSS P25774 1/20 0.36

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
SCHEMBL26072716 1.00 GPR119 (0.43) GPR119STAT3PTGS2JAK2JAK3
SCHEMBL26072047 0.92 GPR119 (0.45) GPR119STAT3CCR2
SCHEMBL31576220 0.92 GPR119 (0.45) GPR119STAT3CCR2
SCHEMBL29396269 0.92 GPR119 (0.42) GPR119STAT3PTGS2
SCHEMBL26072118 0.92 GPR119 (0.42) GPR119STAT3PTGS2
SCHEMBL30442239 0.91 GPR119 (0.42) GPR119STAT3PTGS2
SCHEMBL26072673 0.91 GPR119 (0.42) GPR119STAT3PTGS2
SCHEMBL31576213 0.86 CCR2 (0.38) STAT3PTGS2JAK2JAK3PTK2
SCHEMBL26072351 0.86 CCR2 (0.38) STAT3PTGS2JAK2JAK3PTK2
SCHEMBL29395772 0.78 CCR2 (0.44) JAK2JAK3PTK2CCR2

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
EP-4200298-A1 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 Company (US) 2023-06-28 — — EP disclosed
WO-2022040267-A1 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 COMPANY (US) 2022-02-24 — — WO disclosed
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