SCHEMBL17082137

SCHEMBL17082137

CCOC(=O)Nc1cnc(N2CCC[C@@]3(CCN([C@H]4CC[C@H](O)CC4)C3=O)C2)c(C)c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.36
RAB9A P51151 2/20 0.34
NPC1 O15118 1/20 0.34
MAPT P10636 1/20 0.34
CASP3 P42574 1/20 0.34
SENP8 Q96LD8 1/20 0.34
SENP7 Q9BQF6 1/20 0.34
SENP6 Q9GZR1 1/20 0.34
OGA O60502 1/20 0.34
TSHR P16473 1/20 0.33
FSHR P23945 1/20 0.33
DHODH Q02127 2/20 0.33
GRIN2D O15399 1/20 0.32
GRIN3B O60391 1/20 0.32
GRIN1 Q05586 1/20 0.32
GRIN2A Q12879 1/20 0.32
GRIN2B Q13224 1/20 0.32
GRIN2C Q14957 1/20 0.32
GRIN3A Q8TCU5 1/20 0.32
OPRK1 P41145 5/20 0.32

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
SCHEMBL17082191 1.00 ALDH1A1 (0.36) ALDH1A1RAB9ANPC1MAPTCASP3
SCHEMBL4570147 1.00 ALDH1A1 (0.36) ALDH1A1RAB9ANPC1MAPTCASP3
SCHEMBL4570219 1.00 ALDH1A1 (0.36) ALDH1A1RAB9ANPC1MAPTCASP3
SCHEMBL17082072 0.94 SMN1; SMN2 (0.38) ALDH1A1RAB9ANPC1MAPTOGA
SCHEMBL4570148 0.94 SMN1; SMN2 (0.38) ALDH1A1RAB9ANPC1MAPTOGA
SCHEMBL17082038 0.94 SMN1; SMN2 (0.38) ALDH1A1RAB9ANPC1MAPTOGA
SCHEMBL4570220 0.94 SMN1; SMN2 (0.38) ALDH1A1RAB9ANPC1MAPTOGA
SCHEMBL17082168 0.92 DHODH (0.34) ALDH1A1OGADHODHOPRK1AADAT
SCHEMBL17082142 0.92 DHODH (0.34) ALDH1A1OGADHODHOPRK1AADAT
SCHEMBL4570146 0.92 DHODH (0.34) ALDH1A1OGADHODHOPRK1AADAT

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-1812005-B1 LACTAM COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORP (US) 2015-09-16 EP disclosed