SCHEMBL4755645

SCHEMBL4755645

CCc1ccc(OC(=O)c2ccc3nc(N)nc(N)c3c2)c(OC)c1

nearest known ligand 0.69

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
DHFR P00374 7/20 0.53
MAPT P10636 1/20 0.46

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
SCHEMBL4753695 0.88 MAPT (0.50) DHFRMAPT
SCHEMBL4753235 0.88 KMT2A (0.52) DHFR
SCHEMBL4753856 0.87 DHFR (0.48) DHFRMAPT
SCHEMBL4755401 0.84 DHFR (0.52) DHFRMAPT
SCHEMBL4756506 0.84 DHFR (0.50) DHFR
SCHEMBL6745912 0.81 DHFR (0.59) DHFR
SCHEMBL4753155 0.81 DHFR (0.48) DHFR
SCHEMBL4753175 0.81 DHFR (0.46) DHFR
SCHEMBL4755224 0.80 DHFR (0.52) DHFR
SCHEMBL13984040 0.78 DHFR (0.53) DHFRMAPT

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
WO-2008152142-A1 2 -AMINOQUINAZOLINE DERIVATIVES AND THEIR THERAPEUTIC USES SOFTCURE PHARMACEUTICALS AB (SE) 2008-12-18 WO claimed
WO-2008152142-A1 2 -AMINOQUINAZOLINE DERIVATIVES AND THEIR THERAPEUTIC USES SOFTCURE PHARMACEUTICALS AB (SE) 2008-12-18 WO disclosed
WO-2008152142-A1 2 -AMINOQUINAZOLINE DERIVATIVES AND THEIR THERAPEUTIC USES SOFTCURE PHARMACEUTICALS AB (SE) 2008-12-18 WO disclosed