SCHEMBL28003243

SCHEMBL28003243

[HH].c1ncc2ncncc2n1

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EGFR P00533 9/20 0.48
HSP90AA1 P07900 1/20 0.35
PIK3CD O00329 1/20 0.33
PIK3CA P42336 1/20 0.33
CDC25B P30305 1/20 0.31
PIK3CG P48736 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
SCHEMBL127479 0.96 EGFR (0.50) EGFRHSP90AA1PIK3CDPIK3CACDC25B
Pyrrole SCHEMBL82596 0.78 EGFR (0.43) EGFRPIK3CDPIK3CA
SCHEMBL51486 0.76 EGFR (0.52) EGFRPIK3CDPIK3CA
SCHEMBL29367065 0.76 EGFR (0.52) EGFRPIK3CDPIK3CA
SCHEMBL30148832 0.76 EGFR (0.37) EGFR
SCHEMBL28742280 0.76 EGFR (0.52) EGFRPIK3CDPIK3CA
SCHEMBL3970860 0.74 MAP4K4 (0.38) EGFRPIK3CDPIK3CAPIK3CG
SCHEMBL5763741 0.74 EGFR (0.53) EGFRHSP90AA1PIK3CDPIK3CA
Hydrochloric Acid SCHEMBL30980980 0.74 EGFR (0.50) EGFRPIK3CDPIK3CA
SCHEMBL3941600 0.74 EGFR (0.35) EGFR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102203976-B Radiation-emitting organic component and method for producing a radiation-emitting organic component OSRAM OPTO SEMICONDUCTORS GMBH 2015-04-15 CN disclosed