SCHEMBL7279946

SCHEMBL7279946

CCCc1nc(Cl)ccc1-c1ccncc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 2/20 0.36
PDE3A Q14432 2/20 0.36
HEXA P06865 1/20 0.35
HEXB P07686 1/20 0.35
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
NPC1 O15118 3/20 0.33
RAB9A P51151 3/20 0.33
MAPT P10636 3/20 0.33
GCGR P47871 3/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
GFER P55789 1/20 0.33
ALDH1A1 P00352 2/20 0.33
GSK3B P49841 2/20 0.33
NFKB1 P19838 1/20 0.33
S1PR1 P21453 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
LMNA P02545 1/20 0.32

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
SCHEMBL7280225 0.92 MAPT (0.40) PDE3BPDE3ACYP3A4CYP2D6NPC1
SCHEMBL11176428 0.90 CYP3A4 (0.39) CYP3A4CYP2D6NPC1RAB9AMAPT
SCHEMBL7282284 0.86 PDE3B (0.44) PDE3BPDE3ACYP3A4CYP2D6NPC1
SCHEMBL11065116 0.83 GABRP (0.42) PDE3BPDE3AHEXAHEXBCYP3A4
SCHEMBL11167856 0.79 GSK3B (0.38) CYP3A4NPC1RAB9AMAPTSMN1; SMN2
SCHEMBL7279983 0.78 DYRK1A (0.48) PDE3BPDE3ACYP3A4CYP2D6MAPK1
SCHEMBL11235206 0.78 PDE3B (0.38) PDE3BPDE3AHEXAHEXBCYP3A4
SCHEMBL11164012 0.75 GABRP (0.51) PDE3BPDE3ACYP3A4CYP2D6NPC1
SCHEMBL11074069 0.74 GABRP (0.47) PDE3BPDE3ACYP3A4CYP2D6NPC1
SCHEMBL7281511 0.73 PDE3B (0.41) PDE3BPDE3ANPC1RAB9AMAPT

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4463008-A 2-Alkoxy-5-(pyridinyl)pyridines and cardiotonic use thereof STERLING DRUG INC. (US) 1984-07-31 US disclosed
EP-0109027-A1 Pyridine derivatives, process for their preparation and composition containing them STERLING DRUG INC. (US) 1984-05-23 EP disclosed
US-4420617-A 5(Pyridinyl)pyridin-2-amines STERLING DRUG INC. (US) 1983-12-13 US disclosed
US-4351941-A Pyridinyl-pyridines STERLING DRUG INC. (US) 1982-09-28 US disclosed
US-4331672-A 5-(Pyridinyl)pyridine-2-hydrazines, their preparation and their cardiotonic use STERLING DRUG INC. (US) 1982-05-25 US disclosed
US-4309537-A Production of imidazo[4,5-b]pyridin-2-ones or thiones STERLING DRUG INC. (US) 1982-01-05 US disclosed
US-4297360-A 5-(Pyridinyl)pyridine-2,3-diamines, preparation thereof and their cardiotonic use STERLING DRUG INC. (US) 1981-10-27 US disclosed
US-4294837-A 1,3-Dihydro-6-(pyridinyl)-2H-imidazo[4,5-b]pyridin-2-ones and -imidazo[4,5-b]pyridine-2-thiones and their cardiotonic use STERLING DRUG INC. (US) 1981-10-13 US disclosed
US-4276293-A Compositions and their preparation STERLING DRUG INC. (US) 1981-06-30 US disclosed