SCHEMBL22919269

SCHEMBL22919269

CCCCCC(=O)NCCCC(CC)CCC

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ FAAH O00519 5/20 0.56
▸ CASP2 P42575 1/20 0.53
▸ DNM1 Q05193 2/20 0.53
▸ NAAA Q02083 1/20 0.50
▸ EPHX2 P34913 3/20 0.48
▸ SLC6A5 Q9Y345 2/20 0.47
▸ CNR1 P21554 2/20 0.46
▸ CA2 P00918 2/20 0.46
▸ NOD1 Q9Y239 1/20 0.46

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
SCHEMBL23480269 0.95 FAAH (0.49) FAAHCASP2DNM1NAAAEPHX2
SCHEMBL31088254 0.86 FAAH (0.64) FAAHCASP2DNM1NAAAEPHX2
SCHEMBL7163016 0.84 NAAA (0.61) FAAHCASP2DNM1NAAAEPHX2
SCHEMBL22912622 0.84 FAAH (0.50) FAAHCASP2DNM1NAAAEPHX2
SCHEMBL23375897 0.83 CA2 (0.58) FAAHCASP2DNM1NAAACNR1
SCHEMBL27110298 0.81 CASP2 (0.63) FAAHCASP2DNM1NAAAEPHX2
SCHEMBL23472179 0.81 FAAH (0.61) FAAHCASP2DNM1NAAAEPHX2
SCHEMBL25229329 0.81 CASP2 (0.59) FAAHCASP2DNM1NAAAEPHX2
SCHEMBL12792260 0.80 CASP2 (0.62) FAAHCASP2DNM1NAAAEPHX2
SCHEMBL12791885 0.80 CASP2 (0.62) FAAHCASP2DNM1NAAAEPHX2

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
WO-2021014415-A2 SMALL MOLECULE INHIBITORS OF ACETYL COENZYME A SYNTHETASE SHORT CHAIN 2 (ACSS2) CURADEV PHARMA PVT. LTD. (IN) 2021-01-28 — — WO disclosed
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