SCHEMBL11109456

SCHEMBL11109456

CCC(Nc1ncnc(Br)c1C)c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 7/20 0.58
▸ RPS6KB1 P23443 1/20 0.49
▸ LMNA P02545 1/20 0.47
▸ P2RX3 P56373 2/20 0.45
▸ CRHR1 P34998 3/20 0.42

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
SCHEMBL11105495 0.83 EGFR (0.52) EGFRRPS6KB1LMNAP2RX3CRHR1
SCHEMBL11104368 0.81 GALR3 (0.57) EGFRLMNA
SCHEMBL11281906 0.77 EGFR (0.52) EGFRRPS6KB1LMNAP2RX3CRHR1
SCHEMBL11105703 0.74 EGFR (0.52) EGFRRPS6KB1LMNAP2RX3CRHR1
SCHEMBL4572186 0.72 RPS6KB1 (0.53) EGFRRPS6KB1LMNAP2RX3
SCHEMBL4572192 0.72 RPS6KB1 (0.53) EGFRRPS6KB1LMNAP2RX3
SCHEMBL11108426 0.72 MAOA (0.48) LMNA
SCHEMBL3952919 0.71 EGFR (0.49) EGFRRPS6KB1CRHR1
SCHEMBL11105507 0.71 AKT1 (0.44) EGFRRPS6KB1LMNAP2RX3
SCHEMBL11286075 0.71 EGFR (0.46) EGFRRPS6KB1LMNAP2RX3CRHR1

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-4435402-A Aminopyrimidine derivatives, processes for their preparation, and fungicidal, insecticidal and acaricidal compositions containing them SANKYO COMPANY, LIMITED (JP) 1984-03-06 — — US disclosed
EP-0057440-A1 Aminopyrimidine derivatives, processes for their preparation, and fungicidal, insecticidal and acaricidal compositions containing them SANKYO COMPANY LIMITED (JP) 1982-08-11 — — EP disclosed
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