SCHEMBL3328223

SCHEMBL3328223

CCCCCCC(=O)OC1CCN(C)C(C)(C)C1C

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 2/20 0.48
PRKCA P17252 6/20 0.42
SMN1; SMN2 Q16637 1/20 0.38
GNAI3 P08754 4/20 0.37
GNAO1 P09471 4/20 0.37
GNAI1 P63096 4/20 0.37
DGKA P23743 1/20 0.37

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
SCHEMBL9479699 1.00 NAAA (0.48) NAAAPRKCASMN1; SMN2GNAI3GNAO1
SCHEMBL28986889 0.99 NAAA (0.46) NAAAPRKCASMN1; SMN2GNAI3GNAO1
SCHEMBL28986887 0.95 NAAA (0.40) NAAAPRKCASMN1; SMN2
SCHEMBL3459903 0.95 SMN1; SMN2 (0.41) NAAAPRKCASMN1; SMN2
SCHEMBL29029463 0.93 NAAA (0.42) NAAADGKA
SCHEMBL8008803 0.90 SMN1; SMN2 (0.38) NAAAPRKCASMN1; SMN2
SCHEMBL7760256 0.88 SMN1; SMN2 (0.39) NAAASMN1; SMN2
SCHEMBL29093548 0.83 NAAA (0.37) NAAAPRKCASMN1; SMN2
SCHEMBL29192592 0.81 SMN1; SMN2 (0.33) NAAAPRKCASMN1; SMN2
SCHEMBL29106464 0.78 NAAA (0.47) NAAAPRKCADGKA

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-20100136004-A1 COMPOSITIONS AND METHODS FOR TREATING NEUROLOGICAL DISORDERS MEDICAL COLLEGE OF GEORGIA RESEARCH INSTITUTE, INC. 2010-06-03 US disclosed
WO-2008148023-A2 COMPOSITIONS AND METHODS FOR TREATING NEUROLOGICAL DISORDERS MEDICAL COLLEGE OF GEORGIA RESEARCH INSTITUTE, INC. (US) 2008-12-04 WO disclosed