SCHEMBL10666236

SCHEMBL10666236

CCCCCOc1cc(N(CC)CC)ccc1C1(c2c(C)n(C)c3ccccc23)OC(=O)c2ncccc21

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 4/20 0.34
MAPT P10636 3/20 0.34
NPSR1 Q6W5P4 2/20 0.34
LMNA P02545 2/20 0.34
USP2 O75604 1/20 0.34
KCNA3 P22001 1/20 0.33
ALDH1A1 P00352 3/20 0.32
KDM4E B2RXH2 2/20 0.32
HSD17B10 Q99714 2/20 0.32
HPGD P15428 1/20 0.32
MEN1 O00255 2/20 0.32
TSHR P16473 2/20 0.32
KMT2A Q03164 2/20 0.32
NPC1 O15118 2/20 0.32
HBB P68871 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
HCRTR1 O43613 1/20 0.32
CASP1 P29466 1/20 0.32
CASP7 P55210 1/20 0.32
ATM Q13315 1/20 0.32

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
SCHEMBL3180248 0.92 MAPT (0.35) HTTMAPTNPSR1LMNAUSP2
SCHEMBL21142029 0.91 PLA2G2A (0.32) HTTMAPTLMNAALDH1A1MEN1
SCHEMBL10662690 0.89 HTT (0.34) HTTMAPTNPSR1LMNAUSP2
SCHEMBL29735494 0.89 NPSR1 (0.33) HTTMAPTNPSR1LMNAUSP2
SCHEMBL214264 0.89 NPSR1 (0.33) HTTMAPTNPSR1LMNAUSP2
SCHEMBL3187839 0.88 CNR2 (0.40) HTTALDH1A1KDM4EMEN1KMT2A
SCHEMBL3190315 0.87 CNR2 (0.39) HTTALDH1A1KDM4EMEN1KMT2A
SCHEMBL3181448 0.87 CNR2 (0.39) HTTALDH1A1KDM4EMEN1KMT2A
SCHEMBL3190107 0.87 CNR2 (0.39) HTTALDH1A1KDM4EMEN1KMT2A
SCHEMBL3171252 0.87 CNR2 (0.39) HTTALDH1A1KDM4EMEN1KMT2A

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
US-4747875-A Chromogenic azaphthalide compound and a colour-forming recording composition containing the same YAMADA CHEMICAL CO., LTD. (JP) 1988-05-31 US claimed
US-4747875-A Chromogenic azaphthalide compound and a colour-forming recording composition containing the same YAMADA CHEMICAL CO., LTD. (JP) 1988-05-31 US disclosed