SCHEMBL28016277

SCHEMBL28016277

CCCCCCC(C)ON=O.CCCCCCC(C)ON=O

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FAAH O00519 5/20 0.43
CNR1 P21554 1/20 0.42
CNR2 P34972 1/20 0.42
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
OPRM1 P35372 1/20 0.39
SMPD1 P17405 3/20 0.38
ACE2 Q9BYF1 1/20 0.38
ALDH1A1 P00352 1/20 0.38
GPR84 Q9NQS5 3/20 0.38
FDPS P14324 3/20 0.38
SPHK1 Q9NYA1 1/20 0.38
FFAR1 O14842 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
SCHEMBL10581380 1.00 FAAH (0.43) FAAHCNR1CNR2ADH1BADH1C
SCHEMBL27913104 1.00 FAAH (0.43) FAAHCNR1CNR2ADH1BADH1C
SCHEMBL27597909 1.00 FAAH (0.43) FAAHCNR1CNR2ADH1BADH1C
Ammonia Solution, Strong SCHEMBL28075224 0.98 FAAH (0.42) FAAHCNR1CNR2ADH1BADH1C
SCHEMBL27491382 0.98 FAAH (0.42) FAAHCNR1CNR2ADH1BADH1C
SCHEMBL3821017 0.98 OPRM1 (0.41) FAAHCNR1CNR2ADH1BADH1C
Ethylene SCHEMBL27905614 0.96 FAAH (0.41) FAAHCNR1CNR2ADH1BADH1C
SCHEMBL27536330 0.92 FAAH (0.42) FAAHCNR1CNR2SMPD1ACE2
SCHEMBL27859881 0.92 FAAH (0.42) FAAHCNR1CNR2SMPD1ACE2
Bicarbonate SCHEMBL27836312 0.92 FAAH (0.46) FAAHCNR1CNR2ACE2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104797921-A Composition for processing histological, cadaver and cytological samples MADAU GIACOMO 2015-07-22 CN disclosed