SCHEMBL5510274

SCHEMBL5510274

CCOC1(C(N)=O)CCCCC1c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
KDM1A O60341 8/20 0.37
MAOA P21397 8/20 0.37
MAOB P27338 8/20 0.37
OPRM1 P35372 2/20 0.36
SLC6A2 P23975 1/20 0.36
SLC6A4 P31645 1/20 0.36
ADORA3 P0DMS8 1/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
KDM4E B2RXH2 1/20 0.35
MAPK1 P28482 1/20 0.34

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
SCHEMBL5508054 0.91 GAA (0.40) GAASMN1; SMN2KDM1AMAOAMAOB
SCHEMBL19817374 0.72 KDM1A (0.38) KDM1AMAOAMAOBMAPK1
SCHEMBL8384320 0.71 THRB (0.35) GAASMN1; SMN2ALDH1A1KDM4EMAPK1
SCHEMBL32690457 0.70 KDM1A (0.44) KDM1AMAOAMAOB
SCHEMBL151522 0.69 TSHR (0.41) GAAALDH1A1MAPK1
SCHEMBL3797329 0.69 FABP7 (0.33) KDM1AALDH1A1
SCHEMBL28279384 0.69 SIGMAR1 (0.41) GAASMN1; SMN2ALDH1A1
SCHEMBL10814139 0.69 LMNA (0.45) GAASMN1; SMN2OPRM1SLC6A4ALDH1A1
SCHEMBL4558507 0.68 KCNQ3 (0.40) KDM1AMAPK1
SCHEMBL10722403 0.68 MAOA (0.42) KDM1AMAOAMAOB

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
EP-1814866-A2 GONADOTROPIN RELEASING HORMONE RECEPTOR ANTAGONISTS Wyeth a Corporation of the State of Delaware (US) 2007-08-08 EP claimed
WO-2006058012-A2 GONADOTROPIN RELEASING HORMONE RECEPTOR ANTAGONISTS WYETH (US) 2006-06-01 WO claimed