SCHEMBL4623974

SCHEMBL4623974

Cc1cc(O)c(-c2c(O)cc(C)cc2C(C)C)c(C(C)C)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.56
TRPA1 O75762 3/20 0.56
SLC6A2 P23975 2/20 0.56
HTR2B P41595 2/20 0.56
CHRM1 P11229 1/20 0.56
ADRA1A P35348 1/20 0.56
SELL P14151 1/20 0.46
SELP P16109 1/20 0.46
SELE P16581 1/20 0.46
ACHE P22303 1/20 0.46
GABRA1 P14867 6/20 0.43
GABRB1 P18505 4/20 0.43
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
PIM1 P11309 2/20 0.41
GABRB2 P47870 4/20 0.40
ALDH1A1 P00352 2/20 0.38
CYP1A2 P05177 2/20 0.38
CYP3A4 P08684 2/20 0.38
TSHR P16473 2/20 0.38

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
SCHEMBL7942520 0.81 GABRA1 (0.61) LMNATRPA1SLC6A2HTR2BCHRM1
SCHEMBL18357201 0.81 ACHE (0.59) LMNATRPA1SLC6A2HTR2BCHRM1
SCHEMBL1487428 0.79 LMNA (0.54) LMNATRPA1SLC6A2HTR2BCHRM1
SCHEMBL12023105 0.79 MAPT (0.43) LMNATRPA1SLC6A2HTR2BCHRM1
SCHEMBL544651 0.77 CA1 (0.67) LMNATRPA1SLC6A2HTR2BCHRM1
SCHEMBL2173349 0.76 GABRA1 (0.68) LMNATRPA1SLC6A2HTR2BCHRM1
SCHEMBL26769093 0.76 SELL (0.65) LMNATRPA1SLC6A2HTR2BCHRM1
SCHEMBL22430739 0.76 LMNA (0.66) LMNATRPA1SLC6A2HTR2BCHRM1
SCHEMBL11974268 0.74 LMNA (0.48) LMNATRPA1SLC6A2HTR2BCHRM1
SCHEMBL9857937 0.73 FABP3 (0.55) LMNATRPA1SLC6A2HTR2BCHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1448620-B1 SUPPORTED BIS(PHOSPHORUS)LIGANDS AND THEIR USE IN THE CATALYSIS INVISTA TECH SARL (CH) 2008-06-04 EP disclosed
US-6984604-B2 Supported bis(phosphorus) ligands and their use in the catalysis INVISTA NORTH AMERICA S.A.R.L. (US) 2006-01-10 US disclosed
EP-1448620-A1 SUPPORTED BIS(PHOSPHORUS)LIGANDS AND THEIR USE IN THE CATALYSIS E. I. du Pont de Nemours and Company (US) 2004-08-25 EP disclosed
US-20030153691-A1 Supported bis(phosphorus) ligands and their use in the catalysis INVISTA NORTH AMERICA S.A.R.L. 2003-08-14 US disclosed
WO-2003046019-A1 SUPPORTED BIS(PHOSPHORUS)LIGANDS AND THEIR USE IN THE CATALYSIS E. I. DU PONT DE NEMOURS AND COMPANY (US) 2003-06-05 WO disclosed