SCHEMBL10679405

SCHEMBL10679405

CCCCc1c(CCCCCCCCCC(C)C)cccc1S(=O)(=O)O

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 7/20 0.38
CYSLTR1 Q9Y271 7/20 0.38
BID P55957 3/20 0.37
MCL1 Q07820 3/20 0.37
BCL2L1 Q07817 2/20 0.37
BAK1 Q16611 2/20 0.37
KAT8 Q9H7Z6 2/20 0.37
PPARA Q07869 2/20 0.37
PPARG P37231 1/20 0.37
EP300 Q09472 1/20 0.37
KAT2A Q92830 1/20 0.37
KAT2B Q92831 1/20 0.37
KAT5 Q92993 1/20 0.37
SAE1 Q9UBE0 1/20 0.37
S1PR2 O95136 1/20 0.37
S1PR1 P21453 1/20 0.37
S1PR3 Q99500 1/20 0.37
LIPG Q9Y5X9 1/20 0.36

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
SCHEMBL10357822 1.00 CYSLTR2 (0.38) CYSLTR2CYSLTR1BIDMCL1BCL2L1
SCHEMBL10699616 1.00 CYSLTR2 (0.38) CYSLTR2CYSLTR1BIDMCL1BCL2L1
SCHEMBL1155266 0.95 CYP1A2 (0.35) CYSLTR2CYSLTR1BIDMCL1BCL2L1
SCHEMBL1155664 0.95 CYP1A2 (0.35) CYSLTR2CYSLTR1BIDMCL1BCL2L1
SCHEMBL11367846 0.95 CYP1A2 (0.35) CYSLTR2CYSLTR1BIDMCL1BCL2L1
SCHEMBL1155389 0.95 CYP1A2 (0.35) CYSLTR2CYSLTR1BIDMCL1BCL2L1
SCHEMBL27847186 0.89 BID (0.46) CYSLTR2CYSLTR1BIDMCL1BCL2L1
SCHEMBL10682316 0.89 BID (0.46) CYSLTR2CYSLTR1BIDMCL1BCL2L1
SCHEMBL11578909 0.89 BID (0.46) CYSLTR2CYSLTR1BIDMCL1BCL2L1
Ammonia Solution, Strong SCHEMBL23749181 0.88 CYP1A2 (0.36)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0272406-A2 Process for an enhanced oil recovery from subterranean formations by surfactant flooding HÜLS AKTIENGESELLSCHAFT (DE) 1988-06-29 EP disclosed
US-4722396-A INJECTION OF TENSIDES HUELS AKTIENGESELLSCHAFT (DE) 1988-02-02 US disclosed
EP-0207312-A2 Method for the recovery of oil from underground formations HÜLS AKTIENGESELLSCHAFT (DE) 1987-01-07 EP disclosed