SCHEMBL6824920

SCHEMBL6824920

Cc1cc(N2CCN(C)CC2)cc(C)c1Nc1cc(-c2ccccc2)nc2ccccc12

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADRA2A P08913 7/20 0.56
▸ ADRA2C P18825 7/20 0.56
▸ ADRA2B P18089 4/20 0.56
▸ KDM1A O60341 3/20 0.51
▸ GLA P06280 1/20 0.50
▸ SLC2A1 P11166 1/20 0.50
▸ RECQL P46063 1/20 0.50
▸ BLM P54132 1/20 0.50
▸ TDP1 Q9NUW8 1/20 0.50
▸ ADRB2 P07550 1/20 0.48
▸ CHRM2 P08172 1/20 0.48
▸ CHRM1 P11229 1/20 0.48
▸ DRD1 P21728 1/20 0.48
▸ SLC6A2 P23975 1/20 0.48
▸ ADRA1D P25100 1/20 0.48
▸ HTR1D P28221 1/20 0.48
▸ SLC6A4 P31645 1/20 0.48
▸ HTR7 P34969 1/20 0.48
▸ ADRA1A P35348 1/20 0.48
▸ HRH1 P35367 1/20 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
SCHEMBL15521729 0.82 ADRA2A (0.75) ADRA2AADRA2CADRA2BKDM1AGLA
SCHEMBL6822156 0.78 GSK3A (0.56) SLC2A1GSK3AGSK3BACP1
SCHEMBL27894556 0.74 KDM4E (0.74) RECQLHTR3AKMT2AKDM4EMAPT
SCHEMBL20642864 0.74 DNMT1 (0.58) SLC2A1KMT2AACP1SMARCA2
SCHEMBL29636698 0.73 ACP1 (0.53) ADRA2AADRA2CADRA2BSLC2A1KDM4E
SCHEMBL6749969 0.72 SLC2A1 (0.70) ADRA2AADRA2CADRA2BSLC2A1KDM4E
SCHEMBL7127754 0.72 ADRA2A (1.00) ADRA2AADRA2CADRA2BKDM1AGLA
SCHEMBL12323601 0.72 KDM4E (0.62) ADRA2AADRA2CADRA2BKDM1AGLA
SCHEMBL6751610 0.71 SLC2A1 (0.61) SLC2A1KDM4ENPC1MAPTRAB9A
SCHEMBL6748821 0.70 SLC2A1 (0.60) SLC2A1KDM4ENPC1MAPTRAB9A

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
WO-2004067513-A1 ANTAGONISTS FOR ALPHA-2 ADRENOCEPTORS OY JUVANTIA PHARMA LTD (FI) 2004-08-12 — — WO claimed
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