SCHEMBL7920165

SCHEMBL7920165

Cc1cccc(-c2cc(=O)c3ccc(C)nc3[nH]2)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 6/20 0.77
ADORA1 P30542 6/20 0.77

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
SCHEMBL1536293 0.87 ADORA2A (1.00) ADORA2AADORA1
SCHEMBL7922308 0.86 ADORA2A (0.74) ADORA2AADORA1
SCHEMBL31237859 0.86 ADORA2A (0.74) ADORA2AADORA1
SCHEMBL7920477 0.86 ADORA2A (0.73) ADORA2AADORA1
SCHEMBL7925177 0.84 ADORA2A (0.70) ADORA2AADORA1
SCHEMBL7913595 0.84 ADORA2A (0.79) ADORA2AADORA1
SCHEMBL7920130 0.82 ADORA2A (0.75) ADORA2AADORA1
SCHEMBL7922307 0.81 ADORA2A (0.72) ADORA2AADORA1
SCHEMBL7920486 0.80 ADORA2A (0.76) ADORA2AADORA1
SCHEMBL7921784 0.80 ALDH1A1 (0.51) ADORA2AADORA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6229016-B1 PYRIDOPYRIMIDINE DERIVATIVES AS CHEMICAL INTERMEDIATES; POLYMERIZATION INHIBITION OF TUBULIN THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL 2001-05-08 US disclosed
US-6071930-A FOR INHIBITION OF MITOSIS OR TUMOR GROWTH THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2000-06-06 US disclosed
EP-0971921-A1 2-ARYL-NAPHTHYRIDIN-4-ONES AS ANTITUMOR AGENTS The University of North Carolina at Chapel Hill (US) 2000-01-19 EP disclosed
US-5994367-A PREVENT CELL MITOSIS; ANTICARCINOGENIC AGENTS THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 1999-11-30 US disclosed
WO-1998039332-A1 2-ARYL-NAPHTHYRIDIN-4-ONES AS ANTITUMOR AGENTS THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 1998-09-11 WO disclosed