SCHEMBL8916564

SCHEMBL8916564

CCCc1[nH]c2ccc(OC)cc2c1N1CCC(CC(=O)c2ccc(F)cc2)C1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.41
GAA P10253 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
TP53 P04637 1/20 0.40
DRD2 P14416 2/20 0.39
HTR2A P28223 2/20 0.39
HTR2C P28335 2/20 0.39
HTR2B P41595 2/20 0.39
SIGMAR1 Q99720 2/20 0.39
ALDH1A1 P00352 1/20 0.39
NPC1 O15118 1/20 0.39
HTR6 P50406 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
MAPKAPK2 P49137 2/20 0.38
HSD11B1 P28845 1/20 0.38

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
Hydrochloric Acid SCHEMBL8917131 0.99 KDM4E (0.41) KDM4EGAASMN1; SMN2TP53DRD2
SCHEMBL8916235 0.93 KDM4E (0.42) KDM4EGAASMN1; SMN2TP53DRD2
Hydrochloric Acid SCHEMBL8917071 0.92 KDM4E (0.42) KDM4EGAASMN1; SMN2TP53DRD2
Hydrochloric Acid SCHEMBL8916094 0.90 DRD2 (0.42) DRD2HTR2AHTR2CHTR2BSIGMAR1
Hydrochloric Acid SCHEMBL8916858 0.83 HSD11B1 (0.49) GAASMN1; SMN2DRD2HTR2AHTR2C
Hydrochloric Acid SCHEMBL8917654 0.81 HSD11B1 (0.46) KDM4EGAASMN1; SMN2DRD2HTR2A
SCHEMBL8306212 0.75 HTR2A (0.55) SMN1; SMN2DRD2HTR2ANPC1
Hydrochloric Acid SCHEMBL9073679 0.75 HTR2A (0.54) SMN1; SMN2DRD2HTR2ANPC1
SCHEMBL8306860 0.74 HTR1A (0.62) DRD2
SCHEMBL8916558 0.71 DRD2 (0.40) KDM4ESMN1; SMN2TP53DRD2HTR2A

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
US-5703070-A PSYCHOLOGICAL DISORDERS ADIR ET COMPAGNIE (FR) 1997-12-30 US disclosed