SCHEMBL27628643

SCHEMBL27628643

CCN(CC)c1ccc(-c2cccnc2OC)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 1/20 0.45
NAAA Q02083 1/20 0.44
KDM4E B2RXH2 2/20 0.43
ALDH1A1 P00352 2/20 0.43
MAPT P10636 2/20 0.43
HPGD P15428 2/20 0.43
CASP1 P29466 2/20 0.43
CASP7 P55210 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
NPSR1 Q6W5P4 2/20 0.43
HSD17B10 Q99714 2/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
RXFP1 Q9HBX9 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
DHODH Q02127 1/20 0.43
ALOX5AP P20292 1/20 0.41
FEN1 P39748 1/20 0.41
BTK Q06187 1/20 0.41
FFAR4 Q5NUL3 1/20 0.41

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
SCHEMBL4056518 0.77 DHODH (0.54) LOXL2NAAAALDH1A1MAPTCASP1
SCHEMBL12864093 0.77 NPC1 (0.55) LOXL2NAAAKDM4EALDH1A1HPGD
SCHEMBL13422264 0.77 DHODH (0.53) LOXL2NAAAALDH1A1MAPTMEN1
SCHEMBL29501236 0.77 BTK (0.50) LOXL2NAAAMAPTL3MBTL1DHODH
SCHEMBL29501268 0.76 NPC1 (0.56) LOXL2NAAAKDM4ENPSR1MEN1
SCHEMBL970744 0.76 ALOX5AP (0.49) LOXL2NAAASMN1; SMN2HSD17B10RXFP1
SCHEMBL15674574 0.76 DHODH (0.47) LOXL2NAAAKDM4EALDH1A1MAPT
SCHEMBL15674356 0.76 NPC1 (0.56) LOXL2NAAAKDM4ENPSR1MEN1
SCHEMBL7499757 0.75 NAAA (0.52) LOXL2NAAAL3MBTL1DHODHALOX5AP
SCHEMBL12936654 0.75 NAAA (0.58) LOXL2NAAADHODHALOX5APFEN1

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
CN-1675155-A Process for preparing aryl allyl ethers DOW GLOBAL TECHNOLOGIES INC (US) 2005-09-28 CN disclosed