SCHEMBL31401436

SCHEMBL31401436

NCc1cc2nc(N3CCN(c4cnccn4)CC3)ccc2cn1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ SORD Q00796 2/20 0.51
▸ KDM4E B2RXH2 4/20 0.40
▸ LMNA P02545 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ DRD4 P21917 2/20 0.38
▸ DRD2 P14416 1/20 0.38
▸ DRD3 P35462 1/20 0.38
▸ NPC1 O15118 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ SLC6A7 Q99884 1/20 0.36
▸ HRH3 Q9Y5N1 4/20 0.36
▸ ALDH1A1 P00352 3/20 0.36
▸ PKM P14618 1/20 0.35
▸ SCN9A Q15858 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL31401152 0.85 MAPT (0.42) SORDKDM4ENPC1RAB9AHRH3
SCHEMBL31396039 0.84 MAPT (0.45) SORDKDM4EDRD4NPC1RAB9A
SCHEMBL23706098 0.83 MAP4K4 (0.43) KDM4EL3MBTL1ALDH1A1
SCHEMBL31395896 0.81 NPC1 (0.39) SORDKDM4ENPC1RAB9ASLC6A7
SCHEMBL31401341 0.75 CHRNB2 (0.43) KDM4EL3MBTL1NPC1RAB9AHRH3
SCHEMBL31401410 0.74 PDE10A (0.55) —
SCHEMBL26970022 0.72 PIM1 (0.37) —
SCHEMBL30895900 0.71 HTR3A (0.43) KDM4EHRH3ALDH1A1
SCHEMBL31401353 0.71 HDAC1 (0.51) KDM4ELMNANPC1RAB9AHRH3
SCHEMBL3137995 0.66 HRH3 (0.52) SORDKDM4EDRD4DRD2DRD3

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-4739682-A1 1,6-NAPHTHRIDINE COMPOUNDS AS SMARCA2 INHIBITORS USEFUL FOR THE TREATMENT OF SMARCA4 DEFICIENT CANCERS Janssen Pharmaceutica NV (BE) 2026-05-13 — — EP disclosed
WO-2025008058-A1 1,6-NAPHTHRIDINE COMPOUNDS AS SMARCA2 INHIBITORS USEFUL FOR THE TREATMENT OF SMARCA4 DEFICIENT CANCERS JANSSEN PHARMACEUTICA NV (BE) 2025-01-09 — — WO disclosed
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