SCHEMBL26072151

SCHEMBL26072151

Cn1c(-c2ccc(S(C)(=O)=O)cc2)cc2c(N3CCOCC3)nc(Cl)cc21

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PIK3CA P42336 4/20 0.45
▸ PIK3CG P48736 3/20 0.45
▸ MTOR P42345 3/20 0.43
▸ JAK2 O60674 3/20 0.41
▸ JAK3 P52333 3/20 0.41
▸ PTK2 Q05397 3/20 0.41
▸ PTGS2 P35354 2/20 0.41
▸ PIK3CB P42338 2/20 0.40
▸ PIK3CD O00329 1/20 0.40
▸ GHSR Q92847 1/20 0.39
▸ KCNH2 Q12809 1/20 0.39
▸ ATR Q13535 1/20 0.39
▸ ATRIP Q8WXE1 1/20 0.39
▸ CRHBP P24387 1/20 0.38
▸ CRHR2 Q13324 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ RXFP1 Q9HBX9 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ HDAC1 Q13547 1/20 0.37

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
SCHEMBL26072918 0.80 PTGS2 (0.42) PTGS2PTGS1
SCHEMBL26072098 0.80 JAK2 (0.41) PIK3CAPIK3CGJAK2JAK3PTK2
SCHEMBL29395846 0.79 PTGS2 (0.41) PTGS2PTGS1
SCHEMBL26072684 0.79 PTGS2 (0.41) PTGS2PTGS1
SCHEMBL26072407 0.78 JAK2 (0.46) PIK3CAPIK3CGJAK2JAK3PTK2
SCHEMBL29396361 0.78 JAK2 (0.46) PIK3CAPIK3CGJAK2JAK3PTK2
SCHEMBL26072873 0.77 PIK3CA (0.47) PIK3CAPIK3CGMTORJAK2JAK3
SCHEMBL26072702 0.76 PTGS2 (0.40) PTGS2PTGS1
SCHEMBL26072604 0.75 PTGS2 (0.39) PTGS2PTGS1
SCHEMBL26072059 0.75 KDM5A (0.39) PTGS2MEN1KMT2ARXFP1PTGS1

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 5 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 disclosed
US-20230312565-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 CO (US) 2023-10-05 — — US disclosed
US-20230312565-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 CO (US) 2023-10-05 — — US disclosed
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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230312565-A1 1H-PYRROLO[3,2-C]PYRIDINE AND 1H-PYRROLO[2,3-C]PYRIDINE DERIVATIVES AS TLR9 INHIBITORS FOR THE TREATMENT OF FIBROSIS TLR9, TLR1, TLR7 PIK3CA 501/4885PIK3CG 711/4885MTOR 1055/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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