SCHEMBL257679

SCHEMBL257679

Bc1ccc(C(=O)O)c(CCOC)c1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.39
TSHR P16473 1/20 0.38
MAPK1 P28482 1/20 0.37
ALDH1A1 P00352 3/20 0.36
PPARG P37231 1/20 0.35
PPARA Q07869 1/20 0.35
PTGER4 P35408 1/20 0.35
KDM4E B2RXH2 1/20 0.35
FOLH1 Q04609 1/20 0.34
DCLRE1A Q6PJP8 1/20 0.34
DCLRE1B Q9H816 1/20 0.34
HCAR3 P49019 1/20 0.33
KDM4C Q9H3R0 1/20 0.33
LMNA P02545 1/20 0.33
RAB9A P51151 1/20 0.33
PDE4A P27815 1/20 0.33
PDE4B Q07343 1/20 0.33
PDE4C Q08493 1/20 0.33
PDE4D Q08499 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
SCHEMBL257685 0.86 ALDH1A1 (0.42) TSHRALDH1A1KDM4ELMNA
SCHEMBL256719 0.83 TDP1 (0.41) HCAR2TSHRALDH1A1KDM4EDCLRE1A
SCHEMBL15100967 0.81 KDM4E (0.45) ALDH1A1PTGER4KDM4E
SCHEMBL28622015 0.77 LTB4R (0.47) TSHRMAPK1ALDH1A1KDM4ELMNA
SCHEMBL8245934 0.76 FOLH1 (0.59) TSHRMAPK1ALDH1A1KDM4EFOLH1
SCHEMBL256737 0.75 DCLRE1B (0.40) TSHRALDH1A1KDM4EFOLH1DCLRE1A
SCHEMBL257240 0.74 KDM4E (0.40) TSHRALDH1A1PPARGPPARAKDM4E
SCHEMBL24801286 0.74 APEX1 (0.44) TSHRALDH1A1KDM4EFOLH1DCLRE1A
SCHEMBL17797893 0.73 TSHR (0.46) HCAR2TSHRMAPK1ALDH1A1PPARG
SCHEMBL27760882 0.72 HCAR2 (0.40) HCAR2TSHRMAPK1ALDH1A1KDM4E

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-2012029942-A1 CYCLIC AMIDE DERIVATIVE 大日本住友製薬株式会社 (JP) 2012-03-08 WO disclosed