SCHEMBL8798486

SCHEMBL8798486

FC(F)(F)c1c[nH]c(-c2cccs2)n1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.43
KDM4E B2RXH2 13/20 0.43
ALDH1A1 P00352 10/20 0.43
HPGD P15428 9/20 0.43
KMT2A Q03164 5/20 0.43
HSD17B10 Q99714 4/20 0.43
MAPK1 P28482 4/20 0.43
LMNA P02545 3/20 0.43
HTT P42858 3/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
SDHB P21912 2/20 0.43
S1PR4 O95977 1/20 0.43
TP53 P04637 1/20 0.43
S1PR1 P21453 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
L3MBTL1 Q9Y468 2/20 0.41
TDP1 Q9NUW8 2/20 0.39
TSHR P16473 1/20 0.39
MAPT P10636 5/20 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
SCHEMBL14334477 0.75 KDM4E (0.53) SMN1; SMN2KDM4EALDH1A1HPGDKMT2A
SCHEMBL10614056 0.74 KDM4E (0.45) SMN1; SMN2KDM4EALDH1A1HPGDKMT2A
SCHEMBL11082771 0.74 GAA (0.47) SMN1; SMN2KDM4EALDH1A1HPGDKMT2A
SCHEMBL6866430 0.73 IDO1 (0.35)
SCHEMBL11623789 0.72 HPGD (0.43) KDM4EALDH1A1HPGDHSD17B10NPC1
SCHEMBL27348070 0.72 PTGS1 (0.37) ALDH1A1KMT2ATP53L3MBTL1MAPT
SCHEMBL649565 0.72 HPGD (0.56) KDM4EALDH1A1HPGDKMT2AHSD17B10
SCHEMBL11625133 0.70 KIF11 (0.44) KDM4EALDH1A1HPGDHSD17B10LMNA
SCHEMBL8797359 0.70 GFER (0.50) KDM4EHPGDNPC1RAB9A
SCHEMBL2045079 0.70 METAP1 (0.40) RAB9AADORA2A

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
EP-0772600-A1 1,2-SUBSTITUTED IMIDAZOLYL COMPOUNDS FOR THE TREATMENT OF INFLAMMATION G.D. SEARLE & CO. (US) 1997-05-14 EP disclosed
WO-1996003388-A1 1,2-SUBSTITUTED IMIDAZOLYL COMPOUNDS FOR THE TREATMENT OF INFLAMMATION G.D. SEARLE & CO. (US) 1996-02-08 WO disclosed