SCHEMBL9696027

SCHEMBL9696027

CCCCCCCCCCCCC(C)OCC(C)OC(=O)CC

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FAAH O00519 5/20 0.53
CNR1 P21554 1/20 0.53
CNR2 P34972 1/20 0.53
LMNA P02545 3/20 0.43
NAAA Q02083 2/20 0.42
ALDH1A1 P00352 2/20 0.41
MAPT P10636 2/20 0.41
ACE2 Q9BYF1 1/20 0.39
GPR84 Q9NQS5 2/20 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
SCHEMBL6897022 0.88 FAAH (0.65) FAAHCNR1CNR2LMNANAAA
SCHEMBL6339017 0.88 FAAH (0.65) FAAHCNR1CNR2LMNANAAA
SCHEMBL28763670 0.88 FAAH (0.65) FAAHCNR1CNR2LMNANAAA
SCHEMBL9447664 0.88 FAAH (0.65) FAAHCNR1CNR2LMNANAAA
SCHEMBL8994200 0.88 FAAH (0.65) FAAHCNR1CNR2LMNANAAA
SCHEMBL6906595 0.88 FAAH (0.65) FAAHCNR1CNR2LMNANAAA
SCHEMBL13126847 0.88 FAAH (0.65) FAAHCNR1CNR2LMNANAAA
SCHEMBL4805826 0.88 FAAH (0.65) FAAHCNR1CNR2LMNANAAA
SCHEMBL28213215 0.86 FAAH (0.62) FAAHCNR1CNR2LMNANAAA
SCHEMBL18157282 0.83 NAAA (0.46) FAAHCNR1CNR2LMNANAAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5122519-A Tetracyclines in solvent, gelling vehicle AMERICAN CYANAMID COMPANY (US) 1992-06-16 US claimed
EP-0410099-A1 Stable, cosmetically acceptable topical gel formulation and method of treatment for acne AMERICAN CYANAMID COMPANY (US) 1991-01-30 EP claimed
US-5122519-A Tetracyclines in solvent, gelling vehicle AMERICAN CYANAMID COMPANY (US) 1992-06-16 US disclosed
EP-0410099-A1 Stable, cosmetically acceptable topical gel formulation and method of treatment for acne AMERICAN CYANAMID COMPANY (US) 1991-01-30 EP disclosed