SCHEMBL7915836

SCHEMBL7915836

C=C(O)c1ccc2cccc(-c3c(F)cc(F)cc3Cl)c2c1

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 1/20 0.35
PDK2 Q15119 1/20 0.33
THRA P10827 1/20 0.33
THRB P10828 1/20 0.33
HTR5A P47898 1/20 0.32
PLA2G2D Q9UNK4 1/20 0.32
TRPV1 Q8NER1 1/20 0.30
ABL1 P00519 1/20 0.30
MAPT P10636 1/20 0.30
RORC P51449 1/20 0.30
PDE10A Q9Y233 1/20 0.30
F2 P00734 1/20 0.30
PLG P00747 1/20 0.30
PLAU P00749 1/20 0.30
PLAT P00750 1/20 0.30
KLK1 P06870 1/20 0.30
PRSS1 P07477 1/20 0.30
AR P10275 1/20 0.30

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
SCHEMBL16502660 0.87 PLA2G2D (0.45) GRM2THRATHRBHTR5APLA2G2D
SCHEMBL7916835 0.81 PDE2A (0.35) HTR5AMAPTPDE10APLAU
SCHEMBL16502659 0.81 PDK2 (0.40) PDK2MAPT
SCHEMBL7915672 0.79 HTR5A (0.53) HTR5A
SCHEMBL7916525 0.79 AKR1C3 (0.41) PLA2G2DRORCF2PLGPLAU
SCHEMBL7918472 0.77 HSD17B14 (0.36) THRBPLA2G2DMAPTF2PLG
SCHEMBL16503576 0.77 HSP90AA1 (0.35) THRATHRBTRPV1MAPTF2
SCHEMBL7915822 0.77 PLA2G2D (0.50) HTR5APLA2G2DTRPV1RORC
SCHEMBL7918345 0.76 CYP1A2 (0.40) TRPV1RORCF2PLGPLAU
SCHEMBL7916817 0.76 AKR1C3 (0.41) PLA2G2DMAPTF2PLGPLAU

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-2010090304-A1 ACYLGUANIDINE DERIVATIVE アステラス製薬株式会社 (JP) 2010-08-12 WO disclosed