SCHEMBL8079439

SCHEMBL8079439

CCCCCCCCC(C)C[C]=O

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ACE2 Q9BYF1 1/20 0.48
GPR84 Q9NQS5 7/20 0.43
FFAR1 O14842 2/20 0.43
SPHK1 Q9NYA1 1/20 0.43
MAPT P10636 1/20 0.42
OPRM1 P35372 1/20 0.41
ADH1B P00325 1/20 0.41
ADH1C P00326 1/20 0.41
ADH1A P07327 1/20 0.41
ADH4 P08319 1/20 0.41
ADH7 P40394 1/20 0.41
FFAR4 Q5NUL3 1/20 0.39
FDPS P14324 3/20 0.39

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
SCHEMBL14336195 1.00 ACE2 (0.48) ACE2GPR84FFAR1SPHK1MAPT
SCHEMBL10938434 1.00 ACE2 (0.48) ACE2GPR84FFAR1SPHK1MAPT
SCHEMBL448296 1.00 ACE2 (0.48) ACE2GPR84FFAR1SPHK1MAPT
SCHEMBL1409720 0.98 ACE2 (0.45) ACE2GPR84FFAR1SPHK1MAPT
SCHEMBL1410326 0.91
SCHEMBL7298035 0.82 FFAR1 (0.40) FFAR1FFAR4
SCHEMBL7298037 0.82 FFAR1 (0.40) FFAR1FFAR4
SCHEMBL269374 0.80
SCHEMBL9258970 0.80 ACE2 (0.34) ACE2OPRM1FDPS
SCHEMBL23925000 0.80 ACE2 (0.52) ACE2GPR84FFAR1SPHK1MAPT

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-1027419-A1 LAUNDRY COMPOSITIONS HAVING REDUCED MALODOR AND METHODS FOR PROVIDING THE SAME THE PROCTER & GAMBLE COMPANY (US) 2000-08-16 EP disclosed
WO-1999021954-A1 LAUNDRY COMPOSITIONS HAVING REDUCED MALODOR AND METHODS FOR PROVIDING THE SAME THE PROCTER & GAMBLE COMPANY (US) 1999-05-06 WO disclosed
US-5888992-A PROTEASE INHIBITOR; VIRICIDE NARHEX LIMITED (HK) 1999-03-30 US disclosed