SCHEMBL7033501

SCHEMBL7033501

Cc1cc(O)c(C(C)C)c(Cl)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.45
SELL P14151 1/20 0.44
SELP P16109 1/20 0.44
SELE P16581 1/20 0.44
ACHE P22303 1/20 0.44
TRPA1 O75762 3/20 0.43
CHRM1 P11229 1/20 0.43
SLC6A2 P23975 1/20 0.43
ADRA1A P35348 1/20 0.43
HTR2B P41595 1/20 0.43
ALDH1A1 P00352 2/20 0.38
KMT2A Q03164 2/20 0.38
KDM4E B2RXH2 1/20 0.38
POLB P06746 1/20 0.38
GAA P10253 1/20 0.38
MAPT P10636 1/20 0.38
APEX1 P27695 1/20 0.38
MPI P34949 1/20 0.38
RECQL P46063 1/20 0.38
AHR P35869 1/20 0.37

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
SCHEMBL1494319 0.85 SELL (0.52) LMNASELLSELPSELEACHE
SCHEMBL27864186 0.83 SELL (0.50) LMNASELLSELPSELEACHE
SCHEMBL12295394 0.83 LMNA (0.38) LMNATRPA1CHRM1SLC6A2ADRA1A
SCHEMBL13748754 0.79 TSHR (0.52) LMNACHRM1SLC6A2ADRA1AHTR2B
SCHEMBL3060235 0.79 SELL (0.46) LMNASELLSELPSELEACHE
SCHEMBL24838149 0.77 GABRA1 (0.48) LMNATRPA1ALDH1A1KDM4EGAA
SCHEMBL1487428 0.77 LMNA (0.54) LMNASELLSELPSELEACHE
SCHEMBL12237882 0.76 LMNA (0.39) LMNAALDH1A1KMT2APOLBMAPT
SCHEMBL27595492 0.76 ALDH1A1 (0.45) LMNASELLSELPSELEACHE
SCHEMBL24248982 0.76 SELL (0.48) LMNASELLSELPSELEACHE

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-1133504-B1 METHOD FOR PRODUCING MONOARYLOXY-ANSA-METALLOCENES BASELL POLYOLEFINE GMBH (DE) 2003-03-12 EP claimed
CN-108026077-A PHENOXYMETHYL DERIVATIVES 豪夫迈·罗氏有限公司 2018-05-11 CN disclosed
EP-2787819-A2 MICROBICIDAL COMPOSITION Unilever N.V. (NL) 2014-10-15 EP disclosed
WO-2013083586-A2 MICROBICIDAL COMPOSITION UNILEVER N.V. (NL) 2013-06-13 WO disclosed