SCHEMBL16628329

SCHEMBL16628329

Cc1cc(Cn2cc(C(N)=O)c3ncccc32)ccc1F

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 15/20 0.44
POLB P06746 1/20 0.42
PARP1 P09874 1/20 0.41
PDE6D O43924 1/20 0.41
PDE6A P16499 1/20 0.41
PDE6G P18545 1/20 0.41
PDE6B P35913 1/20 0.41
PDE6C P51160 1/20 0.41
PDE6H Q13956 1/20 0.41
RPS6KB1 P23443 1/20 0.40
GRM2 Q14416 1/20 0.40

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
SCHEMBL19997558 0.84 LMNA (0.53) CHRM1PDE6DPDE6APDE6GPDE6B
SCHEMBL16628263 0.83 POLB (0.56) CHRM1POLBRPS6KB1GRM2
SCHEMBL16628328 0.83 RPS6KB1 (0.54) CHRM1POLBPARP1RPS6KB1GRM2
SCHEMBL18011014 0.83 CHRM1 (0.43) CHRM1PARP1PDE6DPDE6APDE6G
SCHEMBL16628259 0.82 ADRA1D (0.50) CHRM1
SCHEMBL16628260 0.81 CHRM1 (0.46) CHRM1PDE6DPDE6APDE6GPDE6B
SCHEMBL22001753 0.81 POLB (0.53) CHRM1POLBRPS6KB1GRM2
SCHEMBL19997523 0.80 CHRM1 (0.48) CHRM1PARP1PDE6DPDE6APDE6G
SCHEMBL16593320 0.80 CHRM1 (0.73) CHRM1
SCHEMBL16628334 0.80 NPC1 (0.44) CHRM1POLBPARP1PDE6DPDE6A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3489237-B1 4-AZAINDOLE DERIVATIVES EISAI R&D MAN CO LTD (JP) 2020-05-13 EP disclosed
EP-3489237-A1 4-AZAINDOLE DERIVATIVES Eisai R&D Management Co., Ltd. (JP) 2019-05-29 EP disclosed
WO-2015049574-A1 4-AZAINDOLE DERIVATIVES EISAI R&D MANAGEMENT CO., LTD. (JP) 2015-04-09 WO disclosed