SCHEMBL19003544

SCHEMBL19003544

CCCCCC(CCC)N1CCNCC1=O

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GNAI3 P08754 2/20 0.33
GNAO1 P09471 2/20 0.33
GNAI1 P63096 2/20 0.33
SOD3 P08294 2/20 0.32
FAAH O00519 1/20 0.31
NAAA Q02083 1/20 0.31
SIGMAR1 Q99720 2/20 0.30

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
SCHEMBL25653283 0.95 GNAI3 (0.37) GNAI3GNAO1GNAI1SOD3FAAH
SCHEMBL25131961 0.95 GNAI3 (0.37) GNAI3GNAO1GNAI1SOD3FAAH
SCHEMBL30531533 0.82 SMN1; SMN2 (0.36) GNAI3GNAO1GNAI1SOD3FAAH
SCHEMBL1583383 0.79 LMNA (0.35)
SCHEMBL11364988 0.76 LMNA (0.45) FAAH
SCHEMBL23921699 0.74 FAAH (0.51) GNAI3GNAO1GNAI1FAAHNAAA
SCHEMBL25132003 0.74 FAAH (0.51) GNAI3GNAO1GNAI1FAAHNAAA
SCHEMBL23030500 0.72 LMNA (0.47)
SCHEMBL6535777 0.72 LMNA (0.47) FAAH
SCHEMBL19897475 0.72 LMNA (0.47) FAAH

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
EP-2938344-B1 PIPERAZINE-SUBSTITUTED [1,2,4]TRIAZOLO[1,5-C]QUINAZOLIN-5-AMINE COMPOUNDS WITH A2A ANTAGONIST PROPERTIES MERCK SHARP & DOHME (US) 2017-06-21 EP disclosed