SCHEMBL11904045

SCHEMBL11904045

O=C(NOC(=O)C1CCCCC1)c1cnccn1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.63
LMNA P02545 2/20 0.50
GAA P10253 1/20 0.46
SMYD3 Q9H7B4 1/20 0.45
SMN1; SMN2 Q16637 4/20 0.44
TSHR P16473 3/20 0.44
KMT2A Q03164 1/20 0.44
PABPC1 P11940 1/20 0.44
ALDH1A1 P00352 1/20 0.44
HPGD P15428 1/20 0.44
HSD17B10 Q99714 1/20 0.44
PKM P14618 1/20 0.43
ADORA3 P0DMS8 1/20 0.42
MC4R P32245 1/20 0.42
ADRA1A P35348 1/20 0.42
MC3R P41968 1/20 0.42
KDM4E B2RXH2 2/20 0.42
MCL1 Q07820 1/20 0.42
NPC1 O15118 1/20 0.41
TP53 P04637 1/20 0.41

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
SCHEMBL11904184 0.77 ALDH1A1 (0.54) MAPTLMNASMN1; SMN2TSHRALDH1A1
SCHEMBL11202151 0.76 MAPT (0.63) MAPTLMNAGAASMYD3SMN1; SMN2
SCHEMBL20451349 0.75 GAA (0.64) MAPTLMNAGAASMYD3SMN1; SMN2
SCHEMBL12218526 0.75 GAA (0.64) MAPTLMNAGAASMYD3SMN1; SMN2
SCHEMBL3679578 0.74 MAPT (0.69) MAPTLMNAGAASMN1; SMN2TSHR
SCHEMBL3679576 0.72 MAPT (0.68) MAPTLMNAGAASMYD3SMN1; SMN2
SCHEMBL8234022 0.71 LMNA (0.62) MAPTLMNAGAASMYD3SMN1; SMN2
SCHEMBL27843558 0.71 ADORA3 (0.55) GAASMN1; SMN2TSHRKMT2AADORA3
SCHEMBL2411972 0.70 MAPT (0.53) MAPTLMNAGAASMYD3SMN1; SMN2
SCHEMBL10043293 0.70 MAPT (0.53) MAPTLMNAGAASMYD3SMN1; SMN2

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-1975162-B1 OXAZOLONE DERIVATIVE SEIKAGAKU KOGYO CO LTD (JP) 2012-08-15 EP disclosed