SCHEMBL6635285

SCHEMBL6635285

C=CCNCc1c[c]ccc1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DPP7 Q9UHL4 1/20 0.34
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 2/20 0.33
GAA P10253 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
SLC6A2 P23975 1/20 0.31
SLC6A4 P31645 1/20 0.31
SLC6A3 Q01959 1/20 0.31
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 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
Water SCHEMBL3478298 0.79 MEN1 (0.54) DPP7KDM4EALDH1A1GAAMEN1
SCHEMBL1044325 0.77 MEN1 (0.52) KDM4EGAAMEN1KMT2ATDP1
SCHEMBL741766 0.77 DPP7 (0.34) DPP7KDM4EALDH1A1MEN1KMT2A
SCHEMBL681149 0.77 MEN1 (0.56) DPP7KDM4EALDH1A1GAAMEN1
SCHEMBL2477823 0.76 GAA (0.37) KDM4EALDH1A1GAAMEN1KMT2A
Hydrochloric Acid SCHEMBL250190 0.75 MEN1 (0.54) DPP7KDM4EALDH1A1GAAMEN1
SCHEMBL246311 0.75
SCHEMBL366586 0.75 CHRM2 (0.40) DPP7KDM4EALDH1A1GAAMEN1
Bromide SCHEMBL9394202 0.75 MEN1 (0.54) DPP7KDM4EALDH1A1GAAMEN1
Ammonia Solution, Strong SCHEMBL27753398 0.75 MEN1 (0.54) DPP7KDM4EALDH1A1GAAMEN1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1165557-B1 ARYL AND HETEROARYL FUSED AMINOALKYL-IMIDAZOLE DERIVATIVES: SELECTIVE MODULATORS OF GABAa RECEPTORS NEUROGEN CORP (US) 2004-09-29 EP claimed
US-6627624-B1 Agonists, antagonists or inverse agonists for GABAa brain receptors or prodrugs of agonists, antagonists or inverse agonists for GABAa brain receptors, and are therefore useful in the diagnosis and treatment of anxiety, Down Syndrome, NEUROGEN CORPORATION 2003-09-30 US claimed
EP-1165557-B1 ARYL AND HETEROARYL FUSED AMINOALKYL-IMIDAZOLE DERIVATIVES: SELECTIVE MODULATORS OF GABAa RECEPTORS NEUROGEN CORP (US) 2004-09-29 EP disclosed