SCHEMBL25319320

SCHEMBL25319320

O=CCc1ccc(Cl)nc1Nc1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
LMNA P02545 3/20 0.39
PSMD14 O00487 1/20 0.39
ALDH1A1 P00352 1/20 0.39
BCL6 P41182 1/20 0.38
MAPK1 P28482 2/20 0.38
NFKB1 P19838 1/20 0.38
CDK2 P24941 1/20 0.37
PIN1 Q13526 2/20 0.37
NPY5R Q15761 2/20 0.35
BACE1 P56817 1/20 0.35
NPC1 O15118 1/20 0.35
MITF O75030 1/20 0.35
GAA P10253 1/20 0.35
XBP1 P17861 1/20 0.35
HTT P42858 1/20 0.35
RAB9A P51151 1/20 0.35
ATM Q13315 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
SCHEMBL3634212 0.82 LMNA (0.42) MAPTMEN1KMT2ALMNAALDH1A1
SCHEMBL3634956 0.78 TRPV1 (0.43) MEN1KMT2ALMNABACE1GSK3B
SCHEMBL27389237 0.76 MEN1 (0.45) MAPTMEN1KMT2ALMNAPSMD14
SCHEMBL30881071 0.76 MEN1 (0.45) MAPTMEN1KMT2ALMNAPSMD14
SCHEMBL3633702 0.75 DHODH (0.51) MAPTMEN1KMT2AALDH1A1MAPK1
SCHEMBL4532966 0.71 TKT (0.33)
SCHEMBL3634805 0.71 L3MBTL1 (0.47) MAPTMEN1KMT2ALMNAALDH1A1
SCHEMBL13730057 0.70 BCL6 (0.51) MAPTMEN1KMT2ALMNAALDH1A1
SCHEMBL479544 0.70 DHODH (0.57) MAPTMEN1KMT2ALMNAALDH1A1
SCHEMBL25319703 0.70 CRHBP (0.45) MAPTMEN1KMT2ALMNAALDH1A1

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-4466258-A1 NEW BENZIMIDAZOLE PYRIDINE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2024-11-27 EP disclosed
WO-2023139085-A1 NEW BENZIMIDAZOLE PYRIDINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2023-07-27 WO disclosed