SCHEMBL6587504

SCHEMBL6587504

COC(=O)c1cn(C2C=CC(O[Si](C)(C)C(C)(C)C)C2)c2ccc(F)cc12

nearest known ligand 0.41

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTR3A P46098 18/20 0.41
NR4A2 P43354 1/20 0.34
PLA2G2A P14555 1/20 0.34

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
SCHEMBL6587507 1.00 HTR3A (0.41) HTR3ANR4A2PLA2G2A
SCHEMBL6592296 0.86 NR4A2 (0.44) NR4A2
SCHEMBL7655177 0.83 HTR3A (0.44) HTR3ANR4A2
SCHEMBL6588847 0.81 HTR3A (0.54) HTR3A
SCHEMBL6588840 0.81 HTR3A (0.54) HTR3A
SCHEMBL7665245 0.79 HTR3A (0.41) HTR3A
SCHEMBL7661258 0.74 HTR3A (0.42) HTR3A
SCHEMBL14440312 0.70 ICMT (0.40) PLA2G2A
SCHEMBL7667532 0.67 HTR3A (0.51) HTR3A
SCHEMBL6588979 0.67 HTR3A (0.51) HTR3ANR4A2

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-1183252-B1 PHARMACEUTICALLY ACTIVE COMPOUNDS ASTRAZENECA AB (SE) 2004-02-18 EP disclosed
US-6492406-B1 PROTEIN KINASE C INHIBITORS; ANTIINFLAMMATORY AND IMMUNO-SUPPRESSIVE AGENTS ASTRAZENECA AB (SE) 2002-12-10 US disclosed