SCHEMBL7718638

SCHEMBL7718638

O=C(O)CC(CN1CCCC1)C(=O)c1ncc[nH]1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 1/20 0.36
WDR77 Q9BQA1 1/20 0.36
SLC6A4 P31645 2/20 0.35
ALDH1A1 P00352 3/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35
HTT P42858 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
RAB9A P51151 2/20 0.35
MITF O75030 1/20 0.35
GFER P55789 1/20 0.35
PAX8 Q06710 1/20 0.35
ATM Q13315 1/20 0.35
SLC6A3 Q01959 1/20 0.33
ALOX15 P16050 1/20 0.33
CHRM2 P08172 1/20 0.32
ADRA2B P18089 1/20 0.32
DRD3 P35462 1/20 0.32
SIGMAR1 Q99720 1/20 0.32
HRH3 Q9Y5N1 1/20 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
SCHEMBL7718645 0.99 ALDH1A1 (0.37) PRMT5WDR77SLC6A4ALDH1A1MAPT
SCHEMBL7713727 0.89 ALDH1A1 (0.44) PRMT5WDR77ALDH1A1MAPTHTT
SCHEMBL7718197 0.74 RAB9A (0.40) SLC6A4ALDH1A1HTTSMN1; SMN2RAB9A
SCHEMBL7719212 0.73 SLC6A4 (0.48) SLC6A4ALDH1A1MAPTHTTSMN1; SMN2
SCHEMBL7719730 0.73 GSK3B (0.43) SLC6A4ALDH1A1MAPTHTTSMN1; SMN2
SCHEMBL7718161 0.72 ALDH1A1 (0.60) SLC6A4ALDH1A1MAPTHTTSMN1; SMN2
SCHEMBL7717254 0.71 SLC6A4 (0.43) SLC6A4ALDH1A1MAPTHPGDHTT
SCHEMBL6862148 0.71 ALDH1A1 (0.58) SLC6A4ALDH1A1MAPTHTTSMN1; SMN2
SCHEMBL18686653 0.70 KMT2A (0.43) ALDH1A1MAPTHTTSMN1; SMN2RAB9A
SCHEMBL6864372 0.69 ALDH1A1 (0.44) SLC6A4ALDH1A1MAPTHPGDHTT

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
US-6384063-B1 Compound having effect of promoting neuron differentiation NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2002-05-07 US disclosed
EP-0999204-A1 NOVEL COMPOUND HAVING EFFECT OF PROMOTING NEURON DIFFERENTIATION Nippon Kayaku Kabushiki Kaisha (JP) 2000-05-10 EP disclosed