SCHEMBL31192836

SCHEMBL31192836

CCn1ncc(-c2nccc(N)n2)c1O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP11B2 P19099 1/20 0.35
▸ HASPIN Q8TF76 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ APOBEC3A P31941 1/20 0.34
▸ BLM P54132 1/20 0.34
▸ APOBEC3G Q9HC16 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.34
▸ IRAK4 Q9NWZ3 1/20 0.34
▸ PRKD3 O94806 2/20 0.33
▸ PRKD1 Q15139 2/20 0.33
▸ PRKD2 Q9BZL6 2/20 0.33
▸ ADORA3 P0DMS8 1/20 0.30
▸ ADORA2A P29274 1/20 0.30
▸ ADORA1 P30542 1/20 0.30
▸ HTR2C P28335 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30
▸ MKNK1 Q9BUB5 1/20 0.30

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
SCHEMBL31002366 0.82 CYP17A1 (0.39) IRAK4
SCHEMBL31002054 0.81 IRAK4 (0.36) KDM4EALDH1A1POLBGAAAPOBEC3A
SCHEMBL31002406 0.77 IRAK4 (0.34) IRAK4ADORA3ADORA2AADORA1
SCHEMBL30688977 0.76 ADORA2A (0.32) CYP11B2HASPINIRAK4ADORA2A
SCHEMBL29127729 0.76 ADORA2A (0.32) CYP11B2HASPINIRAK4ADORA2A
SCHEMBL31192966 0.75 DYRK1A (0.36) ADORA3ADORA2A
SCHEMBL15742019 0.68 HDAC1 (0.34) ADORA2AADORA1
SCHEMBL23401836 0.67 SMN1; SMN2 (0.47) CYP11B2KDM4EALDH1A1L3MBTL1SMN1; SMN2
SCHEMBL4805334 0.67 — —
SCHEMBL23402623 0.66 CYP11B2 (0.50) CYP11B2SMN1; SMN2

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
EP-4658662-A1 MACROCYCLIC AMINOPYRIDINE COMPOUNDS AS EGFR INHIBITORS Yuhan Corporation (KR) 2025-12-10 — — EP disclosed
WO-2024177360-A1 MACROCYCLIC AMINOPYRIDINE COMPOUNDS AS EGFR INHIBITORS YUHAN CORPORATION (KR) 2024-08-29 — — WO disclosed
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