SCHEMBL7335126

SCHEMBL7335126

CCN1CCN(c2cc(-c3ccc(O)cc3)c3c(n2)CCCCCC3)CC1

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 6/20 0.80
HTR2A P28223 5/20 0.80
POLB P06746 1/20 0.43
ALDH1A1 P00352 4/20 0.40
KDM4E B2RXH2 3/20 0.40
GAA P10253 3/20 0.40
MAPT P10636 2/20 0.40
FGFR1 P11362 1/20 0.40
FGFR2 P21802 1/20 0.40
RAD52 P43351 1/20 0.40
KMT2A Q03164 1/20 0.39
ACP1 P24666 1/20 0.39
HTR1A P08908 2/20 0.38
HTR3A P46098 1/20 0.38
LMNA P02545 1/20 0.38
HTR6 P50406 1/20 0.37
HRH3 Q9Y5N1 1/20 0.36
ESR1 P03372 1/20 0.36
ESRRG P62508 1/20 0.36
DUSP3 P51452 1/20 0.36

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
Blonanserin SCHEMBL28204389 0.90 DRD2 (0.98) DRD2HTR2APOLBALDH1A1KDM4E
SCHEMBL7334897 0.89 DRD2 (1.00) DRD2HTR2APOLBALDH1A1KDM4E
Blonanserin SCHEMBL119669 0.89 DRD2 (1.00) DRD2HTR2APOLBALDH1A1KDM4E
Blonanserin SCHEMBL29379647 0.89 DRD2 (1.00) DRD2HTR2APOLBALDH1A1KDM4E
SCHEMBL7333811 0.88 DRD2 (0.79) DRD2HTR2APOLBALDH1A1KDM4E
Blonanserin SCHEMBL28331931 0.88 DRD2 (0.98) DRD2HTR2APOLBALDH1A1KDM4E
SCHEMBL7358974 0.87 DRD2 (0.77) DRD2HTR2APOLBALDH1A1KDM4E
SCHEMBL7333458 0.87 DRD2 (0.77) DRD2HTR2APOLBALDH1A1GAA
SCHEMBL7333157 0.85 DRD2 (0.93) DRD2HTR2APOLBALDH1A1KDM4E
SCHEMBL7326283 0.80 DRD2 (0.84) DRD2HTR2APOLBALDH1A1KDM4E

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 3 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
EP-0385237-A2 2-(1-piperazinyl)-4-phenylcycloalkanopyridine derivatives, processes for the production thereof, and pharmaceutical composition containing the same DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 1990-09-05 EP disclosed