SCHEMBL3816732

SCHEMBL3816732

CC(=O)N(Cc1ccc(F)cc1F)c1cc(-c2ccccc2)sc1OC(=O)O

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSPO P30536 4/20 0.42
PTGER1 P34995 1/20 0.37
TP53 P04637 1/20 0.36
RIPK1 Q13546 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
CYP3A4 P08684 1/20 0.35
NR3C1 P04150 1/20 0.35
LTB4R2 Q9NPC1 1/20 0.35
DCLRE1B Q9H816 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
SCHEMBL3809662 0.88 ALDH1A1 (0.38) TSPOPTGER1TP53RIPK1MEN1
SCHEMBL3809097 0.88 LTB4R2 (0.41) PTGER1TP53RIPK1MEN1KMT2A
SCHEMBL3809827 0.87 MAPT (0.37) PTGER1TP53RIPK1MEN1KMT2A
SCHEMBL3807289 0.86 RIPK1 (0.41) PTGER1TP53RIPK1
SCHEMBL3810045 0.86 PTGER1 (0.35) PTGER1MEN1KMT2ANR3C1
SCHEMBL3817267 0.86 S1PR1 (0.43) PTGER1TP53RIPK1
SCHEMBL2157860 0.85 TSPO (0.46) TSPOMEN1KMT2A
SCHEMBL3809719 0.83 KMT2A (0.39) TSPOMEN1KMT2A
SCHEMBL3807989 0.82 TSPO (0.46) TSPOMEN1KMT2ALTB4R2
SCHEMBL3812670 0.81 TP53 (0.34) PTGER1TP53KMT2A

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
EP-1401825-B1 THIOPHENE DERIVATIVES AS ANTIVIRAL AGENTS FOR FLAVIVIRUS INFECTION VIROCHEM PHARMA INC (CA) 2009-08-05 EP claimed