SCHEMBL7718161

SCHEMBL7718161

O=C(O)CC(CN1CCCC1)C(=O)c1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.60
HTT P42858 2/20 0.60
RAB9A P51151 2/20 0.60
ATM Q13315 2/20 0.60
MITF O75030 2/20 0.60
SMN1; SMN2 Q16637 2/20 0.60
GFER P55789 2/20 0.60
PAX8 Q06710 1/20 0.60
LMNA P02545 3/20 0.57
HIF1A Q16665 2/20 0.57
MAPT P10636 1/20 0.57
SLC6A4 P31645 2/20 0.52
NTSR1 P30989 1/20 0.49
KMT2A Q03164 4/20 0.47
MEN1 O00255 1/20 0.47
MMP2 P08253 1/20 0.46
MMP9 P14780 1/20 0.46
MMP12 P39900 1/20 0.46
MAPK1 P28482 1/20 0.46
SLC6A3 Q01959 2/20 0.46

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
SCHEMBL6862148 0.98 ALDH1A1 (0.58) ALDH1A1HTTRAB9AATMMITF
SCHEMBL7713764 0.87 MAPT (0.77) ALDH1A1HTTRAB9AATMMITF
SCHEMBL7720921 0.87 POLB (0.54) ALDH1A1HTTRAB9AATMMITF
SCHEMBL6862360 0.85 SLC6A4 (0.69) ALDH1A1HTTRAB9AATMMITF
SCHEMBL7719212 0.85 SLC6A4 (0.48) ALDH1A1HTTRAB9AATMMITF
SCHEMBL7713799 0.85 ALDH1A1 (0.56) ALDH1A1HTTRAB9AATMMITF
SCHEMBL7719244 0.85 ALDH1A1 (0.52) ALDH1A1HTTRAB9AATMMITF
SCHEMBL14068950 0.84 ALDH1A1 (0.60) ALDH1A1HTTRAB9AATMMITF
SCHEMBL6864372 0.84 ALDH1A1 (0.44) ALDH1A1HTTRAB9AATMMITF
SCHEMBL7718155 0.84 ALDH1A1 (0.54) ALDH1A1HTTRAB9AATMMITF

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