SCHEMBL7280225

SCHEMBL7280225

CCCCc1nc(Cl)ccc1-c1ccncc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.40
GCGR P47871 3/20 0.40
NPC1 O15118 3/20 0.40
ALDH1A1 P00352 3/20 0.40
RAB9A P51151 3/20 0.40
NPSR1 Q6W5P4 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
GSK3B P49841 1/20 0.40
NFKB1 P19838 1/20 0.40
S1PR1 P21453 1/20 0.40
NFKB2 Q00653 1/20 0.40
RELA Q04206 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
GABRP O00591 1/20 0.35
GABRD O14764 1/20 0.35
GABRA1 P14867 1/20 0.35
GABRB1 P18505 1/20 0.35
GABRG2 P18507 1/20 0.35
GABRB3 P28472 1/20 0.35

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
SCHEMBL11176428 0.95 CYP3A4 (0.39) MAPTGCGRNPC1ALDH1A1RAB9A
SCHEMBL7279946 0.92 PDE3B (0.36) MAPTGCGRNPC1ALDH1A1RAB9A
SCHEMBL7282284 0.85 PDE3B (0.44) MAPTGCGRNPC1ALDH1A1RAB9A
SCHEMBL11164012 0.84 GABRP (0.51) MAPTGCGRNPC1ALDH1A1RAB9A
SCHEMBL11074069 0.79 GABRP (0.47) MAPTGCGRNPC1ALDH1A1RAB9A
SCHEMBL7272491 0.78 DYRK1A (0.47) MAPTNPC1ALDH1A1RAB9ANPSR1
SCHEMBL11236919 0.78 GSK3B (0.42) MAPTGCGRNPC1ALDH1A1RAB9A
SCHEMBL11167856 0.77 GSK3B (0.38) MAPTNPC1RAB9ASMN1; SMN2GSK3B
SCHEMBL11248447 0.76 SMN1; SMN2 (0.40) MAPTGCGRNPC1ALDH1A1RAB9A
SCHEMBL11065116 0.75 GABRP (0.42) MAPTNPC1ALDH1A1RAB9ANPSR1

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