SCHEMBL5200321

SCHEMBL5200321

O=CCc1ccc(OCc2ccc(I)cc2)c(Cl)c1O

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
APP P05067 14/20 0.44
RXRA P19793 1/20 0.37
RXRB P28702 1/20 0.37
KLK1 P06870 1/20 0.35
F2 P00734 1/20 0.35
TACR2 P21452 1/20 0.34
MRGPRX4 Q96LA9 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
SCHEMBL5199078 0.87 CCR5 (0.36) RXRARXRBTACR2MRGPRX4
SCHEMBL5200479 0.85 SLC26A3 (0.44) MRGPRX4
SCHEMBL5198640 0.80 MEN1 (0.54) APP
SCHEMBL481033 0.75 MAPT (0.54) APPRXRARXRB
SCHEMBL21822829 0.74 ERN1 (0.39) KLK1
SCHEMBL27686251 0.72 APP (0.43) APPRXRARXRBMRGPRX4
SCHEMBL5200639 0.71 PTGER1 (0.34) MRGPRX4
SCHEMBL5722854 0.70 MAPT (0.59)
SCHEMBL1559782 0.70 MAPT (0.43)
SCHEMBL11205526 0.68 MEN1 (0.32)

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1817300-A1 POTENTIATORS OF GLUTAMATE RECEPTORS ELI LILLY AND COMPANY (US) 2007-08-15 EP disclosed
EP-1817301-A1 POTENTIATORS OF GLUTAMATE RECEPTORS ELI LILLY AND COMPANY (US) 2007-08-15 EP disclosed
WO-2006057860-A1 POTENTIATORS OF GLUTAMATE RECEPTORS ELI LILLY AND COMPANY (US) 2006-06-01 WO disclosed
WO-2006057870-A1 POTENTIATORS OF GLUTAMATE RECEPTORS ELI LILLY AND COMPANY (US) 2006-06-01 WO disclosed