SCHEMBL8429336

SCHEMBL8429336

O=C(O)c1ccc(-c2ccc(OCCO)cc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RARB P10826 5/20 0.68
PKM P14618 1/20 0.67
GAA P10253 1/20 0.66
MAPK1 P28482 2/20 0.59
TSHR P16473 2/20 0.59
TP53 P04637 1/20 0.59
PLA2G4B P0C869 2/20 0.57
ALDH1A1 P00352 2/20 0.57
L3MBTL1 Q9Y468 1/20 0.57
USP2 O75604 1/20 0.56
ALOX15 P16050 1/20 0.56
HSD17B10 Q99714 1/20 0.56
SRD5A2 P31213 1/20 0.55
RECQL P46063 1/20 0.55
NR1I2 O75469 1/20 0.55

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
SCHEMBL77587 0.96 PKM (0.71) RARBPKMGAAMAPK1TSHR
SCHEMBL8569877 0.92 PKM (0.78) RARBPKMMAPK1TSHRTP53
SCHEMBL14346716 0.91 RARB (0.71) RARBPKMGAATSHRTP53
Propane SCHEMBL17958832 0.91 TSHR (0.67) RARBPKMGAAMAPK1TSHR
SCHEMBL10408397 0.90 RARB (0.74) RARBPKMTSHRTP53PLA2G4B
SCHEMBL8636286 0.90 RARB (0.74) RARBPKMTSHRTP53PLA2G4B
SCHEMBL5854522 0.90 RARB (0.74) RARBPKMTSHRTP53PLA2G4B
SCHEMBL10408458 0.90 RARB (0.74) RARBPKMTSHRTP53PLA2G4B
SCHEMBL9449719 0.90 RARB (0.74) RARBPKMTSHRTP53PLA2G4B
SCHEMBL6261667 0.90 RARB (0.74) RARBPKMTSHRTP53PLA2G4B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119335104-A Method for detecting related substances in Qu Faluo-containing bulk drug 上海瑞替诺医药科技有限公司 2025-01-21 CN claimed
CN-119335104-A Method for detecting related substances in Qu Faluo-containing bulk drug 上海瑞替诺医药科技有限公司 2025-01-21 CN disclosed
US-5886242-A DOPES FOR NEMATIC OR CHOLESTERIC LIQUID CRYSTALS IN ORDER TO PRODUCE LAYERS WHICH REFLECT IN COLORS; COMPRISING A POLYVALENT CHIRAL GROUP, AT LEAST ONE UNSATURATED GROUP, AT LEAST ONE SPACER AND AT LEAST ONE MESOGENIC POLYVALENT CHIRAL BASF AKTIENGESELLSCHAFT (DE) 1999-03-23 US disclosed
US-5780629-A CONSISTS OF ATLEAST ONE DIVALENT FURAN OR DIFURAN CHIRAL GROUP AND ONE DOUBLE OR TRIPLE BOND CONTAINING POLYMERIZABLE GROUP; USED IN ELECTRO-OPTICAL DISPLAY BASF AKTIENGESELLSCHAFT (DE) 1998-07-14 US disclosed
US-4196279-A BORANE OR METAL TETRAHYDROCARBYLBORON TEIJIN LIMITED (JP) 1980-04-01 US disclosed
US-3984379-A POLYMERIZATION CATALYSTS TEIJIN LIMITED (JA) 1976-10-05 US disclosed