SCHEMBL6946501

SCHEMBL6946501

CCCCCCCCOc1ccc(C(=O)O)cn1

nearest known ligand 0.69

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.69
TP53 P04637 1/20 0.62
TSHR P16473 1/20 0.62
PLA2G4B P0C869 5/20 0.60
RARB P10826 3/20 0.57
L3MBTL1 Q9Y468 1/20 0.55
PLA2G4A P47712 1/20 0.55
HCAR3 P49019 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
SCHEMBL9578575 1.00 MAPT (0.69) MAPTTP53TSHRPLA2G4BRARB
SCHEMBL7548158 1.00 MAPT (0.69) MAPTTP53TSHRPLA2G4BRARB
SCHEMBL4276906 1.00 MAPT (0.69) MAPTTP53TSHRPLA2G4BRARB
SCHEMBL14125959 1.00 MAPT (0.69) MAPTTP53TSHRPLA2G4BRARB
SCHEMBL10662876 0.98 MAPT (0.71) MAPTTP53TSHRPLA2G4BRARB
SCHEMBL1461142 0.94 MAPT (0.73) MAPTTP53TSHRPLA2G4BRARB
SCHEMBL10657063 0.89 MAPT (0.75) MAPTTP53TSHRL3MBTL1HCAR3
SCHEMBL7555804 0.86 MAPT (0.50) MAPTTP53TSHRPLA2G4BRARB
SCHEMBL6953681 0.86 NNMT (0.59) MAPTTP53TSHRPLA2G4B
SCHEMBL7219864 0.85 LMNA (0.62) MAPTTSHRL3MBTL1

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
EP-0639189-B1 PYRIDYLPYRIMIDINES, A METHOD OF PREPARING THEM, AND THEIR USE IN LIQUID-CRYSTAL MIXTURES AVENTIS RES & TECH GMBH & CO (DE) 2003-02-19 EP disclosed
EP-0639189-A1 PYRIDYLPYRIMIDINES, A METHOD OF PREPARING THEM, AND THEIR USE IN LIQUID-CRYSTAL MIXTURES HOECHST AKTIENGESELLSCHAFT (DE) 1995-02-22 EP disclosed
EP-0639189-A4 PYRIDYLPYRIMIDINES, A METHOD OF PREPARING THEM, AND THEIR USE IN LIQUID-CRYSTAL MIXTURES. AVENTIS RES & TECH GMBH & CO (DE) 1993-09-17 EP disclosed
US-5164113-A Ferroelectric, polarization promoters MITSUBISHI RAYON CO., LTD. (JP) 1992-11-17 US disclosed
WO-1992012974-A1 PYRIDYLPYRIMIDINES, A METHOD OF PREPARING THEM, AND THEIR USE IN LIQUID-CRYSTAL MIXTURES HOECHST AKTIENGESELLSCHAFT (DE) 1992-08-06 WO disclosed
EP-0396410-A2 Optical active compound and liquid crystal composition MITSUBISHI RAYON CO., LTD. (JP) 1990-11-07 EP disclosed