SCHEMBL4787473

SCHEMBL4787473

NC(=O)c1cc2cc(F)cc(F)c2[nH]1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 9/20 0.54
MAP2K1 Q02750 1/20 0.40
KDM4E B2RXH2 1/20 0.39
PDPK1 O15530 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39
HPGD P15428 1/20 0.39
TSHR P16473 1/20 0.39
NFKB1 P19838 1/20 0.39
APEX1 P27695 1/20 0.39
CYP2C19 P33261 1/20 0.39
HSD17B10 Q99714 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
DAO P14920 1/20 0.39
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
LOX P28300 1/20 0.38
ERN1 O75460 1/20 0.36
CFD P00746 1/20 0.36
TP53 P04637 1/20 0.36

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
SCHEMBL2576853 0.83 HPGD (0.56) HRH4KDM4EPDPK1ALDH1A1LMNA
SCHEMBL29063260 0.82 HRH4 (0.40) HRH4MAP2K1KDM4EPDPK1ALDH1A1
SCHEMBL16571364 0.82 MAP2K1 (0.50) HRH4MAP2K1KDM4EPDPK1ALDH1A1
SCHEMBL7942068 0.79 HRH4 (0.57) HRH4ALDH1A1HPGDAPEX1HSD17B10
SCHEMBL24113538 0.77 HRH4 (0.54) HRH4TP53POLBMAPTRXFP1
SCHEMBL25764958 0.77 HRH4 (0.54) HRH4KDM4EPDPK1ALDH1A1LMNA
SCHEMBL3965725 0.77 XDH (0.55) HRH4KDM4EALDH1A1LMNAHPGD
SCHEMBL16571303 0.77 GRM2 (0.42) KDM4EPDPK1ALDH1A1LMNAHPGD
SCHEMBL4218397 0.76 HRH4 (0.37) HRH4MAP2K1KDM4EPDPK1ALDH1A1
SCHEMBL29990795 0.75 EIF4A3 (0.48) HRH4MAP2K1KDM4EPDPK1ALDH1A1

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
WO-2008099165-A1 PIPERIDINE DERIVATIVES AND THEIR USE FOR TREATMENT OF CCR8 MEDIATED DISEASES ASTRAZENECA AB (SE) 2008-08-21 WO claimed