SCHEMBL4968065

SCHEMBL4968065

CCOc1ccc(-c2ccc3ncn[c]c3c2)cc1F

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP4K4 O95819 4/20 0.39
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
ALDH1A1 P00352 1/20 0.39
POLB P06746 1/20 0.39
MAPT P10636 1/20 0.39
HPGD P15428 1/20 0.39
MAPK1 P28482 1/20 0.39
KMT2A Q03164 1/20 0.39
HSD17B10 Q99714 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
FAAH O00519 1/20 0.38
KDM1A O60341 2/20 0.37
NAAA Q02083 1/20 0.37
PTGS2 P35354 2/20 0.36
CAMKK1 Q8N5S9 1/20 0.36
CAMKK2 Q96RR4 1/20 0.36
PTGS1 P23219 1/20 0.36
PDGFRB P09619 1/20 0.36
PDGFRA P16234 1/20 0.36

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
SCHEMBL9484876 0.78 L3MBTL1 (0.53) KDM4EMEN1ALDH1A1POLBMAPT
SCHEMBL15404712 0.74 ENPP1 (0.43) L3MBTL1TLR8EGFR
SCHEMBL9476831 0.71 KDM1A (0.44) KDM4EMEN1ALDH1A1POLBMAPT
SCHEMBL16574198 0.70 KDM1A (0.46) KDM4EMEN1ALDH1A1POLBMAPT
SCHEMBL10976808 0.69 CYP17A1 (0.48) KDM4EMEN1ALDH1A1POLBMAPT
SCHEMBL5865754 0.69 L3MBTL1 (0.53) KDM4EMEN1ALDH1A1POLBMAPT
SCHEMBL8993383 0.69 MGLL (0.49) KDM4EMEN1ALDH1A1POLBMAPT
SCHEMBL8993210 0.69 ERN1 (0.56) KDM4EMEN1MAPTMAPK1KMT2A
SCHEMBL13756275 0.67 RXRA (0.47) KDM4EMEN1ALDH1A1POLBMAPT
SCHEMBL11063154 0.67 CYP17A1 (0.46) KDM4EMEN1ALDH1A1POLBMAPT

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-1981876-A1 TRIAZOLOANILINOPYRIMIDINE DERIVATIVES FOR USE AS ANTIVIRAL AGENTS Arrow Therapeutics Limited (GB) 2008-10-22 EP disclosed
WO-2007080401-A1 TRIAZOLOANILINOPYRIMIDINE DERIVATIVES FOR USE AS ANTIVIRAL AGENTS ARROW THERAPEUTICS LIMITED (GB) 2007-07-19 WO disclosed