SCHEMBL11725540

SCHEMBL11725540

CCCCCCCCCCCCCCCCNC(=O)CC(N)=O

nearest known ligand 0.64

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CASP2 P42575 1/20 0.64
NAAA Q02083 1/20 0.60
EPHX1 P07099 7/20 0.59
FAAH O00519 2/20 0.55
MEN1 O00255 1/20 0.52
KMT2A Q03164 1/20 0.52
ZDHHC20 Q5W0Z9 1/20 0.50
ZDHHC2 Q9UIJ5 1/20 0.50
SLC6A5 Q9Y345 1/20 0.50

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
SCHEMBL7749194 1.00 CASP2 (0.64) CASP2NAAAEPHX1FAAHMEN1
SCHEMBL7749152 1.00 CASP2 (0.64) CASP2NAAAEPHX1FAAHMEN1
SCHEMBL8597402 1.00 CASP2 (0.64) CASP2NAAAEPHX1FAAHMEN1
SCHEMBL8603096 1.00 CASP2 (0.64) CASP2NAAAEPHX1FAAHMEN1
SCHEMBL8601944 1.00 CASP2 (0.64) CASP2NAAAEPHX1FAAHMEN1
SCHEMBL9656519 1.00 CASP2 (0.64) CASP2NAAAEPHX1FAAHMEN1
SCHEMBL3351484 0.98 CASP2 (0.61) CASP2NAAAEPHX1FAAHMEN1
SCHEMBL5947032 0.91 CASP2 (0.52) CASP2NAAAEPHX1FAAHMEN1
SCHEMBL28574271 0.90 CASP2 (0.58) CASP2NAAAEPHX1FAAHMEN1
SCHEMBL14370358 0.87 CASP2 (0.75) CASP2NAAAEPHX1FAAHMEN1

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
US-4002797-A Lubricant for wires with enameled or lacquered insulation SIEMENS AKTIENGESELLSCHAFT (DT) 1977-01-11 US disclosed