SCHEMBL16199520

SCHEMBL16199520

Cc1cc(C(=O)c2c[nH]c3ncc(-c4ccc(C(C)N)cc4)cc23)nn1C

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
AXL P30530 3/20 0.43
PAK1 Q13153 6/20 0.42
AAK1 Q2M2I8 2/20 0.42
PKN1 Q16512 1/20 0.40
CAMKK2 Q96RR4 3/20 0.40
BRAF P15056 4/20 0.39
SGK1 O00141 2/20 0.39
PIK3CA P42336 1/20 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
SCHEMBL857852 0.86 MAP3K11 (0.49) AXLPAK1AAK1CAMKK2SGK1
SCHEMBL857911 0.82 KIT (0.52) AXLPAK1AAK1PKN1PIK3CA
SCHEMBL858062 0.81 AXL (0.56) AXLPAK1AAK1CAMKK2
SCHEMBL858780 0.80 BRD4 (0.51) AXLPAK1AAK1PIK3CA
SCHEMBL27804369 0.80 AAK1 (0.42) AXLPAK1AAK1PKN1CAMKK2
SCHEMBL10263401 0.80 AAK1 (0.49) AXLPAK1AAK1SGK1PIK3CA
SCHEMBL857729 0.77 BRAF (0.42) AXLPAK1AAK1PKN1BRAF
SCHEMBL4301666 0.76 PIK3CA (0.51) AXLPAK1CAMKK2BRAFPIK3CA
SCHEMBL859107 0.75 AXL (0.45) AXLPAK1AAK1PKN1CAMKK2
SCHEMBL1364902 0.75 AXL (0.45) AXLPAK1AAK1PKN1CAMKK2

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1696920-B1 COMPOUNDS AND METHODS FOR DEVELOPMENT OF RET MODULATORS PLEXXIKON INC (US) 2014-10-29 EP disclosed