SCHEMBL7718645

SCHEMBL7718645

O=C(O)CC(CN1CCCCC1)C(=O)c1ncc[nH]1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.37
MAPT P10636 1/20 0.37
HPGD P15428 1/20 0.37
PRMT5 O14744 1/20 0.36
WDR77 Q9BQA1 1/20 0.36
SLC6A4 P31645 2/20 0.34
HRH3 Q9Y5N1 3/20 0.34
CHRM2 P08172 2/20 0.34
ADRA2B P18089 2/20 0.34
DRD3 P35462 2/20 0.34
SIGMAR1 Q99720 2/20 0.34
HTT P42858 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
MITF O75030 1/20 0.34
RAB9A P51151 1/20 0.34
GFER P55789 1/20 0.34
PAX8 Q06710 1/20 0.34
ATM Q13315 1/20 0.34
LMNA P02545 1/20 0.33
KCNH2 Q12809 2/20 0.33

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
SCHEMBL7718638 0.99 PRMT5 (0.36) ALDH1A1MAPTHPGDPRMT5WDR77
SCHEMBL7713727 0.88 ALDH1A1 (0.44) ALDH1A1MAPTPRMT5WDR77HTT
SCHEMBL7718197 0.75 RAB9A (0.40) ALDH1A1SLC6A4HRH3CHRM2ADRA2B
SCHEMBL7719212 0.75 SLC6A4 (0.48) ALDH1A1MAPTSLC6A4HRH3CHRM2
SCHEMBL7719730 0.74 GSK3B (0.43) ALDH1A1MAPTSLC6A4ADRA2BHTT
SCHEMBL7717254 0.73 SLC6A4 (0.43) ALDH1A1MAPTHPGDSLC6A4HRH3
SCHEMBL6862148 0.72 ALDH1A1 (0.58) ALDH1A1MAPTSLC6A4HRH3CHRM2
SCHEMBL18686653 0.72 KMT2A (0.43) ALDH1A1MAPTHRH3HTTSMN1; SMN2
SCHEMBL6864372 0.71 ALDH1A1 (0.44) ALDH1A1MAPTHPGDSLC6A4HTT
SCHEMBL7718161 0.71 ALDH1A1 (0.60) ALDH1A1MAPTSLC6A4HRH3CHRM2

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