SCHEMBL27933541

SCHEMBL27933541

C#CC(=O)c1cccc(Br)c1-c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FABP4 P15090 4/20 0.51
▸ HNF4A P41235 1/20 0.39
▸ PRNP P04156 1/20 0.38
▸ FABP3 P05413 1/20 0.38
▸ FABP5 Q01469 1/20 0.38
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ AKR1C4 P17516 1/20 0.36
▸ AKR1C3 P42330 1/20 0.36
▸ AKR1C2 P52895 1/20 0.36
▸ AKR1C1 Q04828 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ PIM1 P11309 1/20 0.36
▸ GFER P55789 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ F2R P25116 1/20 0.35
▸ ALDH1A1 P00352 3/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ HTT P42858 1/20 0.33

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
SCHEMBL2674700 0.80 FABP4 (0.58) FABP4HNF4APRNPFABP3FABP5
SCHEMBL8895763 0.80 FABP4 (0.68) FABP4HNF4APRNPFABP3FABP5
SCHEMBL18104841 0.80 NPC1 (0.43) MEN1KMT2AF2RALDH1A1HPGD
SCHEMBL27950189 0.77 FABP4 (0.55) FABP4HNF4APRNPKDM4EMAPT
SCHEMBL28289664 0.73 FABP4 (0.55) FABP4FABP3FABP5MEN1KMT2A
SCHEMBL9861790 0.73 BCAT2 (0.57) FABP4HNF4AFABP3FABP5MEN1
SCHEMBL8973903 0.71 ALDH1A1 (0.55) FABP4MEN1KMT2AKDM4EMAPT
SCHEMBL28789332 0.70 FABP4 (0.47) FABP4HNF4APRNPMEN1KMT2A
SCHEMBL28531054 0.69 FABP4 (0.46) FABP4HNF4APRNPMEN1KMT2A
SCHEMBL17244263 0.69 MAPT (0.50) MEN1KMT2AKDM4EMAPTTDP1

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
CN-103509009-A 2-substituted-5-phenyl furan compound, and preparation method, pharmaceutical composition and application thereof SHANGHAI INST MATERIA MEDICA 2014-01-15 — — CN disclosed
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