SCHEMBL11240704

SCHEMBL11240704

CCCCCCCCOC(C)(C)CNc1nc(Cl)nc2ccccc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 4/20 0.49
▸ PDE5A O76074 2/20 0.49
▸ KCNA5 P22460 1/20 0.43
▸ ACP1 P24666 1/20 0.43
▸ CASP6 P55212 1/20 0.41
▸ GBA1 P04062 2/20 0.41
▸ NPSR1 Q6W5P4 2/20 0.41
▸ S1PR2 O95136 1/20 0.41
▸ LMNA P02545 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ TLR7 Q9NYK1 2/20 0.40
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ CYP1A2 P05177 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ CLK4 Q9HAZ1 1/20 0.38
▸ SLC2A1 P11166 1/20 0.38
▸ ELANE P08246 2/20 0.38

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
SCHEMBL11665848 0.80 APP (0.63) APPPDE5AACP1CASP6GBA1
SCHEMBL11246699 0.79 APP (0.57) APPPDE5AKCNA5ACP1GBA1
SCHEMBL15502283 0.77 ACP1 (0.68) APPPDE5AACP1CASP6GBA1
SCHEMBL11249591 0.76 GBA1 (0.58) APPPDE5AACP1CASP6GBA1
SCHEMBL17799955 0.75 SLC6A3 (0.59) APPPDE5AKCNA5SMN1; SMN2TLR7
SCHEMBL11240404 0.75 APP (0.52) APPPDE5AKCNA5GBA1LMNA
SCHEMBL11250987 0.75 APP (0.52) APPPDE5AKCNA5ACP1LMNA
SCHEMBL4904310 0.74 APP (0.70) APPPDE5AACP1CASP6NPSR1
SCHEMBL29161537 0.74 APP (0.69) APPPDE5AACP1TLR7CYP1A2
SCHEMBL11259177 0.72 APP (0.49) APPPDE5AKCNA5NPSR1LMNA

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
US-4323680-A 4-Aminoquinazoline compounds useful as agricultural fungicides SANKYO COMPANY LIMITED (JP) 1982-04-06 — — US disclosed
US-4213987-A 4-AMINOQUINAZOLINES SANKYO COMPANY LIMITED (JP) 1980-07-22 — — US disclosed
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