SCHEMBL3883335

SCHEMBL3883335

Cc1ccc(-c2c(C)ccc(C)c2P(=O)(O)O)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.42
TSHR P16473 2/20 0.42
MMP8 P22894 2/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
KIF11 P52732 1/20 0.35
PTK2B Q14289 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35
PTPN5 P54829 1/20 0.35
HPGD P15428 2/20 0.34
GAA P10253 2/20 0.34
PTGS2 P35354 1/20 0.34
KMT2A Q03164 3/20 0.33
ALDH1A1 P00352 2/20 0.33
KDM4E B2RXH2 1/20 0.33
USP2 O75604 1/20 0.33
HSD17B10 Q99714 1/20 0.33
POLB P06746 1/20 0.33
MMP1 P03956 1/20 0.33
MMP2 P08253 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
SCHEMBL3885257 0.82 S1PR3 (0.39) LMNATSHRCA12PTK2BRXFP1
SCHEMBL3895681 0.79 LMNA (0.41) LMNATSHRMMP8CA12CA1
SCHEMBL3896470 0.79 PTPN5 (0.45) TSHRMMP8CA1PTPN5HPGD
SCHEMBL3881976 0.78 LMNA (0.39) LMNATSHRMMP8CA12CA1
SCHEMBL31031192 0.76 TSHR (0.40) LMNATSHRMMP8CA12CA1
SCHEMBL1552134 0.76 TSHR (0.40) LMNATSHRMMP8CA12CA1
SCHEMBL3883333 0.74 LMNA (0.43) LMNATSHRMMP8CA12CA1
SCHEMBL3885852 0.74 PTK2B (0.43) LMNATSHRMMP8CA12CA1
SCHEMBL3887564 0.74 PTPN5 (0.40) LMNATSHRPTK2BRXFP1PTPN5
SCHEMBL29771463 0.73 ESR2 (0.41) LMNATSHRALDH1A1

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
US-20090325065-A1 NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2009-12-31 US disclosed