SCHEMBL7206699

SCHEMBL7206699

N#Cc1nc(O)n(Cc2ccc(F)cc2)c1N

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.40
KDM4E B2RXH2 4/20 0.40
HSD17B10 Q99714 1/20 0.40
MAPT P10636 4/20 0.39
HPGD P15428 2/20 0.39
GLA P06280 1/20 0.39
GAA P10253 1/20 0.39
HTT P42858 3/20 0.38
RAB9A P51151 2/20 0.38
MITF O75030 1/20 0.38
CYP11B1 P15538 1/20 0.36
CYP11B2 P19099 1/20 0.36
LMNA P02545 1/20 0.36
IKBKB O14920 1/20 0.36
TNIK Q9UKE5 1/20 0.36
TYMS P04818 1/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
SLC2A1 P11166 1/20 0.35
TP53 P04637 1/20 0.35

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
SCHEMBL7205531 0.85 TSHR (0.43) ALDH1A1KDM4EHSD17B10HPGDGLA
SCHEMBL4790589 0.71 POLB (0.45) ALDH1A1MAPTHPGDRAB9ACYP11B1
SCHEMBL7336875 0.69 CYP11B1 (0.42) ALDH1A1KDM4EHSD17B10MAPTCYP11B1
SCHEMBL14944610 0.69 AR (0.40) ALDH1A1KDM4EHPGDGLAGAA
SCHEMBL2567869 0.68 ADORA2A (0.48) ALDH1A1KDM4EMAPTHPGDGLA
SCHEMBL4058117 0.68 CDK1 (0.38) ALDH1A1MAPTTP53NPSR1
SCHEMBL5732110 0.67 ADORA2A (0.53) ALDH1A1LMNATSHRCYP3A4CYP2C9
SCHEMBL7209444 0.67 TLR7 (0.38) ALDH1A1KDM4EMAPTHPGDGLA
SCHEMBL18207487 0.67 KMT2A (0.52) ALDH1A1KDM4EHSD17B10MAPTHPGD
SCHEMBL16833355 0.66 SLC2A1 (0.67) ALDH1A1KDM4EHSD17B10MAPTGAA

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-1035123-B1 NOVEL HETEROCYCLIC COMPOUNDS SUMITOMO PHARMA (JP) 2003-08-20 EP disclosed
US-6329381-B1 INTERFERONS, VIRICIDES AND ANTICARCINOGENIC AGENTS SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2001-12-11 US disclosed
EP-1035123-A1 NOVEL HETEROCYCLIC COMPOUNDS SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2000-09-13 EP disclosed