SCHEMBL8942507

SCHEMBL8942507

NC(=O)NCCN(O)C(=O)c1cccc(Oc2cccc(C(F)(F)F)c2)c1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.43
MAPK14 Q16539 1/20 0.43
ALDH1A1 P00352 1/20 0.41
POLB P06746 1/20 0.41
MRGPRX4 Q96LA9 1/20 0.41
NR4A2 P43354 1/20 0.41
F10 P00742 1/20 0.41
GAA P10253 2/20 0.40
MAOB P27338 1/20 0.40
MAPT P10636 2/20 0.40
MAPK1 P28482 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
PRSS1 P07477 1/20 0.39
ACR P10323 1/20 0.39
GHSR Q92847 1/20 0.39
CHEK2 O96017 1/20 0.39
PPARG P37231 1/20 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
SCHEMBL8782309 0.85 POLB (0.52) KDM4EMAPK14ALDH1A1POLBMRGPRX4
SCHEMBL8942679 0.84 MAPT (0.47) POLBNR4A2MAPT
SCHEMBL8942712 0.82 PARP14 (0.45) MRGPRX4NR4A2PPARG
SCHEMBL8942408 0.82 TNKS (0.39) ALDH1A1MRGPRX4MAPT
SCHEMBL8942429 0.82 PARP10 (0.45) ALDH1A1
SCHEMBL8942661 0.81 KMO (0.53) ALDH1A1MRGPRX4CHEK2
SCHEMBL8942753 0.80 PARP1 (0.52) ALDH1A1GAAMAPTTDP1PRSS1
SCHEMBL8942402 0.79 EPOR (0.46) MAPT
SCHEMBL8942585 0.78 MEN1 (0.42) KDM4EALDH1A1F10GAATDP1
SCHEMBL8942628 0.77 SCN7A (0.43) F10PPARG

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
US-5514702-A Arylamidoalkyl-N-hydroxyurea compounds having lipoxygenase inhibitory activity ABBOTT LABORATORIES (US) 1996-05-07 US disclosed