SCHEMBL26072992

SCHEMBL26072992

Cc1nc(-c2ccc(CN3CCN(CC(C)(C)O)CC3)cc2)cc2c1cc(-c1ccc(S(C)(=O)=O)cc1)n2C(F)F

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ CCR2 P41597 14/20 0.38
▸ JAK2 O60674 5/20 0.38
▸ JAK3 P52333 5/20 0.38
▸ PTK2 Q05397 5/20 0.38
▸ STAT3 P40763 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
SCHEMBL31576212 1.00 CCR2 (0.38) CCR2JAK2JAK3PTK2STAT3
SCHEMBL26072193 0.92 CCR2 (0.44) CCR2JAK2JAK3PTK2
SCHEMBL29393831 0.92 CCR2 (0.44) CCR2JAK2JAK3PTK2
SCHEMBL26071958 0.88 CCR2 (0.42) CCR2JAK2JAK3PTK2
SCHEMBL29395751 0.88 CCR2 (0.42) CCR2JAK2JAK3PTK2
SCHEMBL26072351 0.85 CCR2 (0.38) CCR2JAK2JAK3PTK2STAT3
SCHEMBL31576213 0.85 CCR2 (0.38) CCR2JAK2JAK3PTK2STAT3
SCHEMBL29393849 0.81 CCR2 (0.47) CCR2JAK2JAK3PTK2
SCHEMBL26072623 0.81 CCR2 (0.47) CCR2JAK2JAK3PTK2
SCHEMBL26072714 0.80 CCR2 (0.42) CCR2JAK2JAK3PTK2STAT3

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
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

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 CCR2 216/4885JAK2 137/4885JAK3 240/4885

“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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