SCHEMBL31361174

SCHEMBL31361174

Cc1cc(C#N)n(-c2nc(Cl)ccc2OC(F)F)n1

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.33
MBOAT4 Q96T53 1/20 0.33
PDE4B Q07343 1/20 0.32
PDE4D Q08499 1/20 0.32
MEN1 O00255 2/20 0.32
ALDH1A1 P00352 2/20 0.32
MAPT P10636 2/20 0.32
KMT2A Q03164 2/20 0.32
KCNH2 Q12809 1/20 0.32
HTT P42858 2/20 0.31
HPGD P15428 1/20 0.31
TSHR P16473 1/20 0.31
GRM2 Q14416 1/20 0.31
KCNN4 O15554 1/20 0.30
SLC34A1 Q06495 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
SCHEMBL31361141 0.81 MBOAT4 (0.33) KDM4EMBOAT4PDE4BPDE4DMEN1
SCHEMBL31361145 0.77 GRM2 (0.40) KDM4EKMT2AHTTGRM2
SCHEMBL30986468 0.74
SCHEMBL25318266 0.73 MEN1 (0.39) KDM4EMEN1ALDH1A1KMT2AHTT
SCHEMBL31153160 0.73 MEN1 (0.39) KDM4EMEN1ALDH1A1KMT2AHTT
SCHEMBL31361222 0.72 KDM4E (0.36) KDM4EALDH1A1HTT
SCHEMBL31361215 0.71 KDM4E (0.33) KDM4EHTT
SCHEMBL31361233 0.71
SCHEMBL31361117 0.71 KDM4E (0.38) KDM4E
SCHEMBL31078206 0.69 RPS6KA5 (0.35) KDM4EMBOAT4KCNN4

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-4746965-A1 BENZIMIDAZOLES AS SIK-ACTIVITY MODULATORS F. Hoffmann-La Roche AG (CH) 2026-05-27 EP disclosed
WO-2025017041-A1 BENZIMIDAZOLES AS SIK-ACTIVITY MODULATORS F. HOFFMANN-LA ROCHE AG (CH) 2025-01-23 WO disclosed