SCHEMBL7325331

SCHEMBL7325331

Fc1ccc(-c2cc(N3CCN(C4CC4)CC3)nc3c2CCCCCC3)cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 5/20 0.69
HTR2A P28223 5/20 0.69
HRH3 Q9Y5N1 7/20 0.42
KDM4E B2RXH2 3/20 0.40
MAPT P10636 2/20 0.40
ALOX15 P16050 2/20 0.39
LMNA P02545 1/20 0.39
TSHR P16473 1/20 0.39
HTT P42858 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
HSD17B10 Q99714 1/20 0.39
GAA P10253 1/20 0.38
NPC1 O15118 1/20 0.38
ALDH1A1 P00352 1/20 0.38
TP53 P04637 1/20 0.38
POLB P06746 1/20 0.38
HPGD P15428 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
TDP1 Q9NUW8 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
SCHEMBL7333643 0.86 DRD2 (0.75) DRD2HTR2AKDM4EMAPTALOX15
SCHEMBL7332229 0.85 DRD2 (0.77) DRD2HTR2AHRH3KDM4EMAPT
SCHEMBL7328205 0.84 DRD2 (0.75) DRD2HTR2AKDM4EMAPTALOX15
SCHEMBL7324018 0.82 HTR2A (0.70) DRD2HTR2AKDM4EMAPTALOX15
SCHEMBL7330537 0.82 HTR2A (0.70) DRD2HTR2AKDM4EMAPTALOX15
Blonanserin SCHEMBL119669 0.82 DRD2 (1.00) DRD2HTR2AKDM4EMAPTALOX15
SCHEMBL7331193 0.82 DRD2 (0.72) DRD2HTR2AHRH3KDM4EMAPT
Blonanserin SCHEMBL29379647 0.82 DRD2 (1.00) DRD2HTR2AKDM4EMAPTALOX15
SCHEMBL7334897 0.82 DRD2 (1.00) DRD2HTR2AKDM4EMAPTALOX15
SCHEMBL7328947 0.81 HTR2A (0.71) DRD2HTR2AHRH3

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
EP-0385237-B1 2-(1-piperazinyl)-4-phenylcycloalkanopyridine derivatives, processes for the production thereof, and pharmaceutical composition containing the same DAINIPPON PHARMACEUTICAL CO (JP) 1994-06-29 EP disclosed
US-5021421-A Psychotropic agents DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 1991-06-04 US disclosed