SCHEMBL6119514

SCHEMBL6119514

Cc1cc(OC(F)(F)F)c(Br)c(C(=O)O)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MYC P01106 1/20 0.39
▸ KDM4E B2RXH2 2/20 0.39
▸ LCK P06239 1/20 0.38
▸ FYN P06241 1/20 0.38
▸ CSNK2A1 P68400 1/20 0.36
▸ NOTUM Q6P988 1/20 0.36
▸ FABP4 P15090 1/20 0.35
▸ FABP5 Q01469 1/20 0.35
▸ HSD17B10 Q99714 2/20 0.35
▸ TSHR P16473 1/20 0.35
▸ USP2 O75604 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ PTGS1 P23219 1/20 0.35
▸ PTGS2 P35354 1/20 0.35
▸ DHODH Q02127 2/20 0.34
▸ KCNK3 O14649 1/20 0.34
▸ KCNK9 Q9NPC2 1/20 0.34
▸ ALPL P05186 1/20 0.34

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
SCHEMBL6119249 0.84 SOS1 (0.40) KDM4ENOTUMKCNK3KCNK9ALPL
SCHEMBL27053038 0.82 AKR1C2 (0.43) KDM4ECSNK2A1NOTUMFABP4FABP5
SCHEMBL1505292 0.80 CSNK2A1 (0.50) MYCKDM4ECSNK2A1NOTUMHSD17B10
SCHEMBL23858450 0.77 ALDH1A1 (0.46) KDM4ECSNK2A1HSD17B10TSHRUSP2
SCHEMBL27256589 0.76 KDM4E (0.54) MYCKDM4ELCKFYNCSNK2A1
SCHEMBL20763063 0.74 PGK1 (0.40) NOTUMKMO
SCHEMBL3946987 0.74 CFD (0.50) AKR1C2AKR1C1
SCHEMBL3925812 0.73 TAS2R14 (0.43) KDM4EHSD17B10TSHRUSP2ALDH1A1
SCHEMBL16964824 0.73 KDM4E (0.47) MYCKDM4ELCKFYNCSNK2A1
Acetic Acid SCHEMBL28155949 0.73 KDM4E (0.50) MYCKDM4ELCKFYNCSNK2A1

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-2012067663-A1 COMPOUNDS GLAXO GROUP LIMITED (GB) 2012-05-24 — — WO disclosed
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