SCHEMBL14104442

SCHEMBL14104442

Fc1ccc(-c2nc(Oc3ccc(Br)cc3F)c3sccc3n2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MET P08581 5/20 0.38
▸ MAPT P10636 3/20 0.38
▸ MAPK1 P28482 1/20 0.37
▸ EGFR P00533 1/20 0.35
▸ KIT P10721 1/20 0.35
▸ KDR P35968 1/20 0.35
▸ FLT3 P36888 1/20 0.35
▸ ABCG2 Q9UNQ0 4/20 0.34
▸ L3MBTL1 Q9Y468 2/20 0.34
▸ HTT P42858 2/20 0.34
▸ TRPA1 O75762 1/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ RXFP1 Q9HBX9 1/20 0.33
▸ PDE4A P27815 1/20 0.33
▸ PDE4B Q07343 1/20 0.33
▸ PDE4C Q08493 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
SCHEMBL14104083 0.93 L3MBTL1 (0.39) METMAPTMAPK1ABCG2L3MBTL1
SCHEMBL14104446 0.91 TRPA1 (0.41) METMAPTMAPK1EGFRKIT
SCHEMBL14103794 0.86 MAPK1 (0.40) METMAPTMAPK1KITFLT3
SCHEMBL14103795 0.86 L3MBTL1 (0.39) MAPTMAPK1ABCG2L3MBTL1HTT
SCHEMBL14103813 0.84 PIK3CA (0.40) METMAPTMAPK1EGFRKIT
SCHEMBL14103816 0.84 MTOR (0.40) METMAPTMAPK1L3MBTL1TRPA1
SCHEMBL14103885 0.84 TRPA1 (0.38) METMAPTMAPK1L3MBTL1HTT
SCHEMBL4740295 0.84 PTGS1 (0.40) METMAPTMAPK1EGFRKIT
SCHEMBL14104172 0.83 ABCG2 (0.49) MAPTABCG2L3MBTL1HTTCYP1A2
SCHEMBL14103797 0.83 HTT (0.47) MAPTMAPK1ABCG2L3MBTL1HTT

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-2008092861-A1 BICYCLIC DERIVATIVES AS EP4 AGONISTS JANSSEN PHARMACEUTICA N.V. (BE) 2008-08-07 — — WO disclosed
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