SCHEMBL27945472

SCHEMBL27945472

ClC1N=CC=CN1c1ccccc1

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30

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
SCHEMBL28023706 0.77 MAPT (0.30) MAPTNPSR1
SCHEMBL27727248 0.77 MAOA (0.33) MAPTNPSR1
SCHEMBL28024161 0.77 MAPT (0.30) MAPTNPSR1
SCHEMBL28031694 0.73 MEN1 (0.30)
SCHEMBL28032286 0.73 MEN1 (0.30) NPSR1
SCHEMBL28032265 0.70 MEN1 (0.31)
SCHEMBL28023719 0.69 FADS1 (0.38) MAPT
SCHEMBL28031660 0.69 ALDH1A1 (0.33)
SCHEMBL27932348 0.69 CYP19A1 (0.32)
SCHEMBL27992891 0.68 POLB (0.32)

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
CN-103370321-B Kui Linpyrimido quinoline [1, the 2-b] indazole replaced and the purposes of the conditioning agent as PI3K/AKT approach thereof BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-07-29 CN disclosed
CN-103459384-A Benzoxazepines as inhibitors of PI3K/mTOR and methods of their use and manufacture EXELIXIS INC 2013-12-18 CN disclosed
CN-103370321-A Substituted pyrimido[1,2-b]indazoles and their use as modulators of the PI3K/AKT pathway BAYER IP GMBH 2013-10-23 CN disclosed