SCHEMBL31269028

SCHEMBL31269028

Cc1ccnc(Cn2c(-c3ccc(CCN4CC[C@@H](O)C4)cc3Cl)nc3c(OC4(C)CC4)ncnc32)c1

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KCNH2 Q12809 1/20 0.37
▸ SCN5A Q14524 1/20 0.37
▸ SCN9A Q15858 1/20 0.37
▸ PIK3CD O00329 10/20 0.34
▸ PDE2A O00408 1/20 0.33
▸ HRH3 Q9Y5N1 1/20 0.33
▸ EGFR P00533 1/20 0.31
▸ LYN P07948 1/20 0.31
▸ SRC P12931 1/20 0.31
▸ MCHR1 Q99705 2/20 0.31
▸ AVPR1B P47901 1/20 0.30
▸ PDCD1 Q15116 2/20 0.30
▸ CD274 Q9NZQ7 2/20 0.30
▸ S1PR1 P21453 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
SCHEMBL31268817 0.96 KCNH2 (0.38) KCNH2SCN5ASCN9APIK3CDPDE2A
SCHEMBL31269467 0.94 KCNH2 (0.34) KCNH2SCN5ASCN9APIK3CD
SCHEMBL31269000 0.94 PDE2A (0.39) KCNH2SCN5ASCN9APIK3CDPDE2A
SCHEMBL31268776 0.91 KCNH2 (0.41) KCNH2SCN5ASCN9APIK3CDPDE2A
SCHEMBL31269094 0.90 PDK2 (0.37) KCNH2SCN5ASCN9APIK3CDHRH3
SCHEMBL31269371 0.89 KCNH2 (0.36) KCNH2SCN5ASCN9APIK3CDPDE2A
SCHEMBL31269101 0.89 KCNH2 (0.36) KCNH2SCN5ASCN9APIK3CDHRH3
SCHEMBL31269003 0.89 HRH4 (0.36) KCNH2SCN5ASCN9APIK3CDHRH3
SCHEMBL31268859 0.87 SIGMAR1 (0.38) KCNH2SCN5ASCN9APIK3CD
SCHEMBL31269300 0.87 DGAT1 (0.41) KCNH2SCN5ASCN9APIK3CD

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-4689155-A1 USE OF INHIBITORS TO INCREASE EFFICIENCY OF CRISPR/CAS INSERTIONS Astrazeneca AB (SE) 2026-02-11 — — EP disclosed
WO-2024201368-A1 USE OF INHIBITORS TO INCREASE EFFICIENCY OF CRISPR/CAS INSERTIONS ASTRAZENECA AB (SE) 2024-10-03 — — WO disclosed
Send feedback