SCHEMBL10848799

SCHEMBL10848799

COc1ccc(-c2nc3c(C)nccc3[nH]2)c(OC)c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 1/20 0.64
MGAM O43451 2/20 0.51
GAA P10253 2/20 0.51
SI P14410 2/20 0.51
MGAM2 Q2M2H8 2/20 0.51
KDM4E B2RXH2 4/20 0.45
HSD17B10 Q99714 3/20 0.45
CYP1A2 P05177 3/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
CYP3A4 P08684 2/20 0.45
HTT P42858 1/20 0.45
CDC7 O00311 2/20 0.44
ALDH1A1 P00352 2/20 0.44
HPGD P15428 2/20 0.44
DYRK3 O43781 1/20 0.44
CCNT1 O60563 1/20 0.44
CCNB2 O95067 1/20 0.44
CDK1 P06493 1/20 0.44
ADRA2A P08913 1/20 0.44
CYP2D6 P10635 1/20 0.44

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
SCHEMBL10847442 0.87 PDE2A (0.64) PDE2AMGAMGAASIMGAM2
SCHEMBL10844083 0.86 PDE2A (0.62) PDE2AMGAMGAASIMGAM2
SCHEMBL10846727 0.86 PDE2A (0.62) PDE2AMGAMGAASIMGAM2
SCHEMBL10846574 0.86 PDE2A (0.62) PDE2AMGAMGAASIMGAM2
SCHEMBL11770981 0.78 PDE2A (1.00) PDE2AKDM4EHSD17B10CYP1A2ALDH1A1
SCHEMBL10609335 0.78 PDE2A (0.50) PDE2AMGAMGAASIMGAM2
Hydrochloric Acid SCHEMBL11769751 0.77 PDE2A (0.97) PDE2AKDM4EHSD17B10CYP1A2ALDH1A1
SCHEMBL7270959 0.75 PDE2A (0.58) PDE2AGAAKDM4ECYP1A2SMN1; SMN2
SCHEMBL10742148 0.75 PDE2A (0.68) PDE2AGAAKDM4EHSD17B10CYP1A2
SCHEMBL7280668 0.74 PDE2A (0.57) PDE2AMGAMGAASIMGAM2

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
US-4603139-A 2-PHENYL-1H-IMIDAZOL(4,5-C)PYRIDINES, ANTICXOAGULANTS, CARDIOVASCULAR DISORDERS BURROUGHS WELLCOME CO. 1986-07-29 US disclosed
EP-0079083-A1 New imidazo[4,5-c]pyridine derivatives, processes for their preparation and pharmaceutical formulations containing such compounds MERCK PATENT GmbH (DE) 1983-05-18 EP disclosed