SCHEMBL12068601

SCHEMBL12068601

Cc1cc(C2C(=O)C(c3cc(C)c4cc(C(C)C)ccc(C)c3-4)C2=O)c2c(C)ccc(C(C)C)cc1-2

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.48
TRPA1 O75762 1/20 0.43
PTGS1 P23219 1/20 0.43
CACNA1C Q13936 1/20 0.43
BCHE P06276 3/20 0.37
ACHE P22303 3/20 0.37
RNASEH1 O60930 1/20 0.36
HPGD P15428 2/20 0.36
GFER P55789 1/20 0.36
HSD17B10 Q99714 1/20 0.36
ALDH1A1 P00352 2/20 0.34
ALOX12 P18054 2/20 0.34
HTT P42858 2/20 0.34
GAA P10253 1/20 0.34
HIF1A Q16665 1/20 0.34
NR1H3 Q13133 1/20 0.33
TNKS O95271 1/20 0.33
TNKS2 Q9H2K2 1/20 0.33
PARP3 Q9Y6F1 1/20 0.33
KDM4E B2RXH2 1/20 0.33

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
SCHEMBL14351215 0.80 LMNA (0.46) LMNATRPA1PTGS1CACNA1CBCHE
SCHEMBL10843605 0.76 LMNA (0.63) LMNATRPA1PTGS1CACNA1CBCHE
SCHEMBL10843609 0.73 LMNA (0.48) LMNATRPA1PTGS1CACNA1CBCHE
SCHEMBL15878674 0.73 LMNA (0.53) LMNATRPA1PTGS1CACNA1CBCHE
SCHEMBL1101926 0.72 TYR (0.50) LMNATRPA1PTGS1CACNA1CBCHE
SCHEMBL28250769 0.71 LMNA (0.47) LMNATRPA1PTGS1CACNA1CBCHE
SCHEMBL17229430 0.71 LMNA (0.47) LMNATRPA1PTGS1CACNA1CBCHE
SCHEMBL9618308 0.71 PTGS1 (0.46) LMNATRPA1PTGS1CACNA1CBCHE
SCHEMBL9660963 0.71 LMNA (0.43) LMNATRPA1PTGS1CACNA1CBCHE
SCHEMBL17229433 0.70 LMNA (0.50) LMNATRPA1PTGS1CACNA1CBCHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011147819-A2 SOLID-STATE PROCESSING OF PI-CONJUGATED MATERIALS Eidgenössische Technische Hochschule Zürich (CH) 2011-12-01 WO disclosed