SCHEMBL31396262

SCHEMBL31396262

CC(C)(C)OC(=O)N1CCN(c2cc([N+](=O)[O-])cc(Br)n2)CC12CC2

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.42
▸ MAPT P10636 2/20 0.42
▸ LMNA P02545 1/20 0.42
▸ KCNH2 Q12809 1/20 0.42
▸ RET P07949 5/20 0.40
▸ JAK3 P52333 3/20 0.37
▸ NR1H2 P55055 1/20 0.34
▸ NR1H3 Q13133 1/20 0.34
▸ MET P08581 1/20 0.33
▸ GPR119 Q8TDV5 2/20 0.31
▸ CYP11B2 P19099 1/20 0.31
▸ CKS1B P61024 1/20 0.31
▸ SKP1 P63208 1/20 0.31
▸ SKP2 Q13309 1/20 0.31

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
SCHEMBL31396179 0.84 RET (0.41) KCNH2RETJAK3NR1H2NR1H3
SCHEMBL31401443 0.83 MAPT (0.45) ALDH1A1MAPTLMNARETJAK3
SCHEMBL1580680 0.82 ALDH1A1 (0.59) ALDH1A1MAPTLMNAKCNH2MET
SCHEMBL18186271 0.78 MAPT (0.65) ALDH1A1MAPTLMNANR1H2NR1H3
SCHEMBL25408763 0.77 RET (0.41) ALDH1A1MAPTLMNAKCNH2RET
SCHEMBL31267843 0.76 RET (0.45) RETJAK3NR1H2NR1H3GPR119
SCHEMBL30270990 0.74 RET (0.41) RETJAK3NR1H2NR1H3
SCHEMBL27835006 0.74 KCNH2 (0.38) ALDH1A1MAPTLMNAKCNH2
SCHEMBL31396207 0.73 RET (0.41) RETJAK3NR1H2NR1H3GPR119
SCHEMBL20836796 0.73 MAPT (0.47) ALDH1A1MAPTLMNARETJAK3

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 4 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
EP-4739684-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
WO-2025008060-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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