SCHEMBL7837580

SCHEMBL7837580

c1ncc2ccc(OCCCN3CCCC3)cc2n1

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 10/20 0.53
EGFR P00533 1/20 0.51
KCNH2 Q12809 1/20 0.51
TLR9 Q9NR96 2/20 0.51
TLR7 Q9NYK1 2/20 0.51
ACHE P22303 2/20 0.50

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
SCHEMBL5680969 0.99 HRH3 (0.55) HRH3KCNH2TLR9TLR7ACHE
SCHEMBL6390332 0.92 MAOB (0.52) HRH3EGFRKCNH2
SCHEMBL28032867 0.90 HRH3 (0.62) HRH3EGFR
SCHEMBL30979868 0.89 HRH3 (0.54) HRH3EGFRKCNH2
SCHEMBL30209183 0.89 HRH3 (0.49) HRH3EGFR
SCHEMBL3067381 0.89 HRH3 (0.54) HRH3EGFRKCNH2
SCHEMBL5679317 0.86 HRH3 (0.45) HRH3EGFRTLR9
SCHEMBL6689692 0.86 HRH3 (0.45) HRH3EGFRTLR9TLR7
SCHEMBL18128966 0.83 EGFR (0.54) HRH3EGFR
SCHEMBL28126949 0.83 LTA4H (0.53) HRH3EGFR

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-1154774-A1 QUINAZOLINE DERIVATIVES AS ANGIOGENESIS INHIBITORS AstraZeneca AB (SE) 2001-11-21 EP disclosed
WO-2000047212-A1 QUINAZOLINE DERIVATIVES AS ANGIOGENESIS INHIBITORS ASTRAZENECA AB (SE) 2000-08-17 WO disclosed