SCHEMBL7718197

SCHEMBL7718197

O=C(O)CC(CN1CCCCC1)C(=O)c1ccc[nH]1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.40
GFER P55789 2/20 0.40
ALDH1A1 P00352 2/20 0.40
MITF O75030 1/20 0.40
HTT P42858 1/20 0.40
PAX8 Q06710 1/20 0.40
ATM Q13315 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
TSHR P16473 1/20 0.40
NPC1 O15118 1/20 0.40
NTSR1 P30989 1/20 0.38
SLC6A4 P31645 1/20 0.38
ABCB1 P08183 3/20 0.38
CHRM2 P08172 1/20 0.37
ADRA2B P18089 1/20 0.37
DRD3 P35462 1/20 0.37
SIGMAR1 Q99720 1/20 0.37
HRH3 Q9Y5N1 1/20 0.37
OPRM1 P35372 1/20 0.37
OPRD1 P41143 1/20 0.37

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 0.79 ALDH1A1 (0.58) RAB9AGFERALDH1A1MITFHTT
SCHEMBL7718161 0.77 ALDH1A1 (0.60) RAB9AGFERALDH1A1MITFHTT
SCHEMBL7717254 0.76 SLC6A4 (0.43) RAB9AGFERALDH1A1MITFHTT
SCHEMBL7718645 0.75 ALDH1A1 (0.37) RAB9AGFERALDH1A1MITFHTT
SCHEMBL7718210 0.74 KMT2A (0.50) RAB9AGFERALDH1A1MITFHTT
SCHEMBL7713750 0.74 ALDH1A1 (0.44) RAB9AGFERALDH1A1MITFHTT
SCHEMBL7718638 0.74 PRMT5 (0.36) RAB9AGFERALDH1A1MITFHTT
SCHEMBL6862360 0.73 SLC6A4 (0.69) RAB9AGFERALDH1A1MITFHTT
SCHEMBL7719212 0.73 SLC6A4 (0.48) RAB9AGFERALDH1A1MITFHTT
SCHEMBL7719730 0.73 GSK3B (0.43) RAB9AGFERALDH1A1MITFHTT

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