SCHEMBL7187736

SCHEMBL7187736

Cc1ccc(O)c(P(c2ccccc2)C(C)(C)C)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.39
FTO Q9C0B1 1/20 0.39
TP53 P04637 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
ESR1 P03372 1/20 0.38
ESR2 Q92731 1/20 0.38
CNR1 P21554 2/20 0.37
CNR2 P34972 2/20 0.37
CSNK2A1 P68400 1/20 0.37
KCNMA1 Q12791 1/20 0.36
ALOX15 P16050 2/20 0.36
HSD17B10 Q99714 2/20 0.36
ALDH1A1 P00352 2/20 0.36
HTT P42858 2/20 0.36
MEN1 O00255 3/20 0.35
GAA P10253 3/20 0.35
KMT2A Q03164 3/20 0.35
LMNA P02545 2/20 0.35
MAPT P10636 2/20 0.35
HPGD P15428 2/20 0.35

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
SCHEMBL5596168 0.86 TRPA1 (0.48) TRPA1FTOTP53TDP1ESR1
SCHEMBL7189644 0.79 ALOX15 (0.45) TRPA1FTOTP53TDP1ESR1
SCHEMBL5596542 0.79 ALOX15 (0.45) TRPA1FTOTP53TDP1ESR1
SCHEMBL19228258 0.74 ACHE (0.44) TP53TDP1CNR1CNR2ALDH1A1
SCHEMBL7193988 0.73 TRPA1 (0.39) TRPA1FTOTP53TDP1ESR1
SCHEMBL22829802 0.72 ACHE (0.38) FTOTDP1ESR1ESR2ALDH1A1
SCHEMBL22829801 0.72 ACHE (0.38) FTOTDP1ESR1ESR2ALDH1A1
SCHEMBL5596307 0.72 ALDH1A1 (0.44) TRPA1TP53TDP1ESR1ESR2
SCHEMBL301240 0.71 CYP3A4 (0.45) TDP1ESR1ESR2ALOX15ALDH1A1
SCHEMBL11610203 0.70 ALDH1A1 (0.50) TRPA1FTOTP53TDP1ESR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6559326-B1 Substituted phosphinophenoxide-metal complexes for the polymerization of olefins BASF AKTIENGESELLSCHAFT (DE) 2003-05-06 US disclosed
EP-1101768-B1 Substituted Phosphanylphenolato[P,O]-metal-complexes for Polymerisation of Olefines BASF AG (DE) 2002-10-02 EP disclosed
EP-1101768-A1 Substituted Phosphanylphenolato[P,O]-metal-complexes for Polymerisation of Olefines BASF AKTIENGESELLSCHAFT (DE) 2001-05-23 EP disclosed