SCHEMBL8501107

SCHEMBL8501107

CCCCCCC(C)O[NH]

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.44
FAAH O00519 5/20 0.43
CNR1 P21554 1/20 0.42
CNR2 P34972 1/20 0.42
SPHK1 Q9NYA1 1/20 0.41
LMNA P02545 1/20 0.41
DNM1 Q05193 2/20 0.40
TSHR P16473 1/20 0.40
THRB P10828 1/20 0.40
ADH1B P00325 1/20 0.39
ADH1C P00326 1/20 0.39
ADH1A P07327 1/20 0.39
ADH4 P08319 1/20 0.39
ADH7 P40394 1/20 0.39
SMPD1 P17405 2/20 0.38
ALDH1A1 P00352 1/20 0.38
ACE2 Q9BYF1 1/20 0.38

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
SCHEMBL7101242 0.90
SCHEMBL1932673 0.79 OPRM1 (0.48) OPRM1FAAHCNR1CNR2SPHK1
SCHEMBL1311730 0.79 OPRM1 (0.48) OPRM1FAAHCNR1CNR2SPHK1
SCHEMBL31121318 0.79 OPRM1 (0.48) OPRM1FAAHCNR1CNR2SPHK1
SCHEMBL6420889 0.79 OPRM1 (0.48) OPRM1FAAHCNR1CNR2SPHK1
SCHEMBL7757207 0.79 OPRM1 (0.48) OPRM1FAAHCNR1CNR2SPHK1
SCHEMBL1932307 0.79 OPRM1 (0.48) OPRM1FAAHCNR1CNR2SPHK1
SCHEMBL5012572 0.79 OPRM1 (0.48) OPRM1FAAHCNR1CNR2SPHK1
SCHEMBL534657 0.79 OPRM1 (0.48) OPRM1FAAHCNR1CNR2SPHK1
SCHEMBL1930626 0.79 OPRM1 (0.48) OPRM1FAAHCNR1CNR2SPHK1

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
US-5886175-A TETRACYCLINE ANTIBIOTICS AMERICAN CYANAMID COMPANY (US) 1999-03-23 US disclosed
US-5512553-A PREVENTING OR TREATING BACTERIAL INFECTIONS AMERICAN CYANAMID COMPANY (US) 1996-04-30 US disclosed