SCHEMBL14355809

SCHEMBL14355809

CC(C)c1nccn1Cc1ccccc1N1CCN(C)CC1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
BRD9 Q9H8M2 6/20 0.45
BRPF1 P55201 3/20 0.45
NCF1 P14598 1/20 0.45
DRD2 P14416 3/20 0.43
DRD3 P35462 3/20 0.43
HTR1A P08908 1/20 0.43
DRD4 P21917 1/20 0.43
HTR2A P28223 1/20 0.43
HTR2C P28335 1/20 0.43
MC4R P32245 1/20 0.42
CYP2D6 P10635 1/20 0.41
TSHR P16473 1/20 0.41
CYP2C19 P33261 1/20 0.41
HIF1A Q16665 1/20 0.41
KCNH2 Q12809 2/20 0.40
BRD4 O60885 2/20 0.40
ADRA2C P18825 2/20 0.40
BRD7 Q9NPI1 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL14355971 0.86 HTR6 (0.49) DRD2DRD3HTR1ADRD4HTR2A
SCHEMBL14355806 0.83 MC4R (0.50) BRD9BRPF1NCF1DRD2DRD3
SCHEMBL14355815 0.82 DRD2 (0.51) BRD9BRPF1NCF1DRD2DRD3
SCHEMBL14387751 0.81 OPRD1 (0.47) MC4R
SCHEMBL14355811 0.78 DRD2 (0.44) BRD9BRPF1NCF1DRD2DRD3
SCHEMBL14355877 0.73 NCF1 (0.51) BRD9BRPF1NCF1DRD2DRD3
SCHEMBL15928086 0.72 TDP1 (0.54) CYP2D6TSHRCYP2C19HIF1AKCNH2
SCHEMBL14355793 0.71 CYP11B1 (0.56) BRD9BRPF1NCF1DRD2DRD3
SCHEMBL9341301 0.70 TDP1 (0.58) CYP2D6TSHRCYP2C19HIF1AKCNH2
SCHEMBL18781674 0.70 NCF1 (0.58) BRD9BRPF1NCF1DRD2DRD3

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-7291619-B2 Melanocortin receptor agonists ELI LILLY AND COMPANY (US) 2007-11-06 US disclosed