SCHEMBL11297877

SCHEMBL11297877

OCCCCCC(O)Cc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CSNK1E P49674 1/20 0.46
TRPA1 O75762 4/20 0.45
MMP1 P03956 2/20 0.41
MMP3 P08254 2/20 0.41
MMP8 P22894 2/20 0.41
TDP1 Q9NUW8 1/20 0.40
TRPV1 Q8NER1 1/20 0.40
CYP1A2 P05177 1/20 0.39
EPHX1 P07099 1/20 0.39
CCR3 P51677 1/20 0.39
ADRB3 P13945 1/20 0.39
FOLH1 Q04609 1/20 0.39
TSHR P16473 1/20 0.38
SRR Q9GZT4 1/20 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
SCHEMBL27622402 1.00 CSNK1E (0.46) CSNK1ETRPA1MMP1MMP3MMP8
SCHEMBL17075353 1.00 CSNK1E (0.46) CSNK1ETRPA1MMP1MMP3MMP8
SCHEMBL27890776 1.00 CSNK1E (0.46) CSNK1ETRPA1MMP1MMP3MMP8
SCHEMBL1598160 0.98 CSNK1E (0.44) CSNK1ETRPA1MMP1MMP3MMP8
SCHEMBL875439 0.92 TRPA1 (0.44) CSNK1ETRPA1TDP1CYP1A2EPHX1
SCHEMBL4964246 0.92 TRPA1 (0.44) CSNK1ETRPA1TDP1CYP1A2EPHX1
SCHEMBL4964239 0.92 TRPA1 (0.44) CSNK1ETRPA1TDP1CYP1A2EPHX1
SCHEMBL5097040 0.86 TRPA1 (0.48) CSNK1ETRPA1TRPV1CYP1A2EPHX1
SCHEMBL27696412 0.84 PPARG (0.46) TRPA1MMP1MMP3MMP8TRPV1
SCHEMBL5868422 0.84 TRPA1 (0.47) TRPA1TDP1TRPV1CYP1A2EPHX1

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-0036155-A2 Polymerisable phospholipids, process for their preparation, polymeric phospholipids, process for their preparation as well as the use of the polymeric phospholipids Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 1981-09-23 EP claimed
EP-0002062-B1 CYCLIC ORGANOPHOSPHORUS COMPOUNDS, METHOD FOR THEIR PREPARATION AND THEIR USE Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 1982-05-05 EP disclosed
EP-0036155-A2 Polymerisable phospholipids, process for their preparation, polymeric phospholipids, process for their preparation as well as the use of the polymeric phospholipids Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 1981-09-23 EP disclosed
EP-0002062-A1 Cyclic organophosphorus compounds, method for their preparation and their use Max-Planck-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 1979-05-30 EP disclosed