SCHEMBL27468628

SCHEMBL27468628

CCCCS(=O)(=O)O.CCCC[PH](CCCC)(CCCC)CCCC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.41
EPHX2 P34913 1/20 0.39
LMNA P02545 3/20 0.37
TP53 P04637 3/20 0.37
S1PR2 O95136 2/20 0.37
S1PR1 P21453 2/20 0.37
ALDH1A1 P00352 2/20 0.37
NPC1 O15118 1/20 0.37
S1PR4 O95977 1/20 0.37
POLB P06746 1/20 0.37
MAPT P10636 1/20 0.37
HPGD P15428 1/20 0.37
XBP1 P17861 1/20 0.37
MAPK1 P28482 1/20 0.37
AGTR1 P30556 1/20 0.37
HTT P42858 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
HSD17B10 Q99714 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
SCHEMBL13043123 0.95 APP (0.41) APPEPHX2LMNATP53S1PR2
SCHEMBL1638913 0.91 EPHX2 (0.47) APPEPHX2S1PR2S1PR1FAAH
SCHEMBL1639212 0.91 EPHX2 (0.47) APPEPHX2S1PR2S1PR1FAAH
SCHEMBL4250715 0.87 EPHX2 (0.44) APPEPHX2TP53S1PR2S1PR1
Sulfuric Acid SCHEMBL3698698 0.85 TP53 (0.43) TP53ALDH1A1HTTFAAHCES2
SCHEMBL31512497 0.85
SCHEMBL5015 0.85
SCHEMBL10012319 0.85
SCHEMBL22609074 0.83 CA2 (0.40) TP53ALDH1A1HTTCA1CA2
Sulfuric Acid SCHEMBL7637283 0.83 TP53 (0.41) TP53ALDH1A1HTTFAAHCES2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1152913-C Antistatic agent 2004-06-09 CN disclosed
CN-1370200-A Antistatic agent BAYER AG (DE) 2002-09-18 CN disclosed