SCHEMBL4041268

SCHEMBL4041268

Clc1cc(CN=C(c2ccccc2)c2ccccc2)c(OCc2ccccc2)c2ncccc12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 8/20 0.45
SMN1; SMN2 Q16637 6/20 0.45
MAPT P10636 5/20 0.45
HIF1A Q16665 1/20 0.45
LMNA P02545 7/20 0.42
ALDH1A1 P00352 5/20 0.42
ALOX12 P18054 4/20 0.42
NPSR1 Q6W5P4 4/20 0.42
CCR6 P51684 1/20 0.42
KDM4E B2RXH2 8/20 0.40
L3MBTL1 Q9Y468 6/20 0.40
TDP1 Q9NUW8 4/20 0.39
TP53 P04637 3/20 0.39
RAB9A P51151 3/20 0.39
MAPK1 P28482 2/20 0.39
TSHR P16473 2/20 0.39
NPC1 O15118 1/20 0.39
POLB P06746 1/20 0.39
HSP90AA1 P07900 2/20 0.39
MMP9 P14780 2/20 0.39

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
SCHEMBL4042845 0.80 HIF1A (0.48) HTTSMN1; SMN2MAPTHIF1ALMNA
SCHEMBL14649411 0.80 EGLN1 (0.43) HTTSMN1; SMN2MAPTLMNAALDH1A1
SCHEMBL4038202 0.79 ADAMTS5 (0.43) HTTSMN1; SMN2MAPTHIF1ALMNA
SCHEMBL3822384 0.78 HIF1A (0.64) HTTSMN1; SMN2MAPTHIF1ALMNA
SCHEMBL1811084 0.78 HIF1A (0.49) HTTSMN1; SMN2MAPTHIF1ALMNA
SCHEMBL1811826 0.78 HIF1A (0.46) HTTSMN1; SMN2MAPTHIF1ALMNA
SCHEMBL12622768 0.78 HIF1A (0.46) HTTSMN1; SMN2MAPTHIF1ALMNA
SCHEMBL1815491 0.77 HIF1A (0.46) HTTSMN1; SMN2MAPTHIF1ALMNA
SCHEMBL12622766 0.76 HIF1A (0.44) HTTSMN1; SMN2MAPTHIF1ALMNA
SCHEMBL14033221 0.74 HIF1A (0.40) HTTSMN1; SMN2MAPTHIF1ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2079699-A1 QUINOLINE DERIVATIVES Envivo Pharmaceuticals, Inc. (US) 2009-07-22 EP disclosed
WO-2008014602-A1 QUINOLINE DERIVATIVES ENVIVO PHARMACEUTICALS, INC. (US) 2008-02-07 WO disclosed
WO-2008014602-A1 QUINOLINE DERIVATIVES ENVIVO PHARMACEUTICALS, INC. (US) 2008-02-07 WO disclosed