SCHEMBL9533235

SCHEMBL9533235

Cc1ccccc1C1=CCN(CCC2OCCO2)CC1

nearest known ligand 0.55

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTR1D P28221 5/20 0.44
HTR1B P28222 4/20 0.44
DRD2 P14416 4/20 0.44
HTR1A P08908 4/20 0.43
DRD4 P21917 2/20 0.39
SIGMAR1 Q99720 1/20 0.39
KDM4E B2RXH2 1/20 0.38
LMNA P02545 1/20 0.38
ALOX15 P16050 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
SCHEMBL10576624 0.81 DRD2 (0.48) DRD2HTR1ADRD4SIGMAR1KDM4E
SCHEMBL9536817 0.79 DRD2 (0.48) DRD2HTR1ADRD4SIGMAR1KDM4E
SCHEMBL3847417 0.76 DRD2 (0.41) HTR1DHTR1BDRD2HTR1ADRD4
SCHEMBL9531082 0.75 SIGMAR1 (0.57) DRD2HTR1ASIGMAR1
SCHEMBL9529720 0.75 SIGMAR1 (0.57) HTR1DDRD2HTR1ASIGMAR1
SCHEMBL9530704 0.75 SIGMAR1 (0.40) HTR1DDRD2DRD4SIGMAR1
SCHEMBL9532157 0.75 SIGMAR1 (0.54) HTR1DHTR1BHTR1ASIGMAR1KDM4E
SCHEMBL3554023 0.75 DRD2 (0.43) DRD2HTR1ADRD4SIGMAR1KDM4E
SCHEMBL2395487 0.73 DRD2 (0.59) DRD2HTR1ADRD4LMNA
SCHEMBL3436391 0.73 KDM4E (0.45) DRD2HTR1ASIGMAR1KDM4ELMNA

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-0556342-A1 NEW 1-AZABICYCLOALKANE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND PROCESS FOR PREPARING SAME GYOGYSZERKUTATO INTEZET K.V. (HU) 1993-08-25 EP disclosed
WO-1992007854-A1 NEW 1-AZABICYCLOALKANE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND PROCESS FOR PREPARING SAME GYÓGYSZERKUTATÓ INTÉZET KV. (HU) 1992-05-14 WO disclosed