SCHEMBL17047862

SCHEMBL17047862

COc1ccc(-c2nc(COCc3ccccn3)co2)cc1OC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.47
MAPT P10636 5/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
SYK P43405 6/20 0.46
NPC1 O15118 3/20 0.44
HSD17B10 Q99714 5/20 0.44
KDM4E B2RXH2 4/20 0.44
TSHR P16473 4/20 0.44
HPGD P15428 3/20 0.44
MAPK1 P28482 2/20 0.44
USP2 O75604 2/20 0.44
LMNA P02545 2/20 0.44
POLB P06746 1/20 0.44
RAB9A P51151 2/20 0.44
ABCB1 P08183 1/20 0.44
ABCC1 P33527 1/20 0.44
ALOX15 P16050 1/20 0.43
ACHE P22303 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.43

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
SCHEMBL17047881 0.91 SYK (0.45) ALDH1A1MAPTMEN1KMT2ASYK
SCHEMBL17047871 0.90 MAPT (0.42) ALDH1A1MAPTMEN1KMT2ASYK
SCHEMBL17047850 0.85 SYK (0.53) SYKNPC1RAB9AAURKBINCENP
SCHEMBL17047885 0.84 MAPT (0.41) ALDH1A1MAPTMEN1KMT2ASYK
SCHEMBL17047853 0.82 SYK (0.40) SYKNPC1RAB9AABCB1ABCC1
SCHEMBL17055728 0.81 SMN1; SMN2 (0.42) ALDH1A1MAPTMEN1KMT2ASYK
SCHEMBL17047857 0.81 FFAR1 (0.44) ALDH1A1MAPTMEN1KMT2ASYK
SCHEMBL17047950 0.80 ALDH1A1 (0.42) ALDH1A1MAPTSYKNPC1KDM4E
SCHEMBL17047855 0.80 PPARA (0.41) ALDH1A1SYKNPC1RAB9ASMN1; SMN2
SCHEMBL17047907 0.79 SYK (0.56) ALDH1A1MAPTMEN1KMT2ASYK

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
WO-2015129755-A1 NOVEL COMPOUND AND TEXTURE IMPROVER CONTAINING SAID COMPOUND 味の素株式会社 2015-09-03 WO disclosed
WO-2015129755-A1 NOVEL COMPOUND AND TEXTURE IMPROVER CONTAINING SAID COMPOUND 味の素株式会社 2015-09-03 WO disclosed