SCHEMBL20797488

SCHEMBL20797488

CC1COc2cc(Br)cnc2N1

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 3/20 0.35
NNMT P40261 2/20 0.33
GRM1 Q13255 2/20 0.33
AR P10275 1/20 0.31
AKR1B1 P15121 1/20 0.31

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
SCHEMBL2459212 0.82 PDE10A (0.38) PDE10ANNMTGRM1AR
SCHEMBL2459207 0.81 PDE10A (0.37) PDE10ANNMTGRM1AR
SCHEMBL15436159 0.78 GRM5 (0.31)
SCHEMBL27534840 0.77
SCHEMBL14305624 0.76 AKR1B1 (0.38) NNMTAKR1B1
SCHEMBL21201833 0.76 NNMT (0.45) PDE10ANNMT
SCHEMBL21201802 0.76 NNMT (0.45) PDE10ANNMT
SCHEMBL14673650 0.75 PNMT (0.33)
SCHEMBL31378896 0.72 AKR1B1 (0.42) AKR1B1
SCHEMBL34463413 0.72 NNMT (0.40) PDE10ANNMTARAKR1B1

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
WO-2019049061-A1 5-(1 H-BENZO[D]IMIDAZO-2-YL)-PYRIDIN-2-AMINE AND 5-(3H-IMIDAZO[4,5-B]PYRIDIN-6-YL)-PYRIDIN-2-AMINE DERIVATIVES AS C-MYC AND P300/CBP HISTONE ACETYLTRANSFERASE INHIBITORS FOR TREATING CANCER GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2019-03-14 WO disclosed
WO-2019049061-A1 5-(1 H-BENZO[D]IMIDAZO-2-YL)-PYRIDIN-2-AMINE AND 5-(3H-IMIDAZO[4,5-B]PYRIDIN-6-YL)-PYRIDIN-2-AMINE DERIVATIVES AS C-MYC AND P300/CBP HISTONE ACETYLTRANSFERASE INHIBITORS FOR TREATING CANCER GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2019-03-14 WO disclosed