SCHEMBL8901917

SCHEMBL8901917

CNc1cc(C(=O)N[C@H]2CCN(C3C4CCCC3CCC4)C2)c(OC)cc1OC

nearest known ligand 0.81

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 7/20 0.81
SIGMAR1 Q99720 6/20 0.57
KDM4E B2RXH2 1/20 0.49
MEN1 O00255 1/20 0.49
MAPT P10636 1/20 0.49
KMT2A Q03164 1/20 0.49
ALDH1A1 P00352 1/20 0.49
DRD2 P14416 2/20 0.48
DRD3 P35462 2/20 0.48

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
SCHEMBL8901921 1.00 DRD4 (0.81) DRD4SIGMAR1KDM4EMEN1MAPT
Hydrochloric Acid SCHEMBL8902305 0.90 DRD4 (0.73) DRD4SIGMAR1KDM4EMEN1MAPT
Hydrochloric Acid SCHEMBL8902290 0.90 DRD4 (0.73) DRD4SIGMAR1KDM4EMEN1MAPT
SCHEMBL8902631 0.88 DRD4 (0.70) DRD4SIGMAR1KDM4EMEN1MAPT
SCHEMBL8902617 0.88 DRD4 (0.70) DRD4SIGMAR1KDM4EMEN1MAPT
SCHEMBL8902225 0.87 DRD4 (0.69) DRD4SIGMAR1KDM4EMEN1MAPT
SCHEMBL8902565 0.87 DRD4 (0.69) DRD4SIGMAR1KDM4EMEN1MAPT
SCHEMBL8902240 0.87 DRD4 (0.69) DRD4SIGMAR1KDM4EMEN1MAPT
SCHEMBL8901965 0.87 DRD4 (0.81) DRD4SIGMAR1
SCHEMBL8901959 0.87 DRD4 (0.81) DRD4SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0757985-A1 N-(3-PYRROLIDINYL)BENZAMIDE DERIVATIVE YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1997-02-12 EP disclosed