SCHEMBL11250238

SCHEMBL11250238

FC(F)(F)c1cccc(OCCNc2ncnc3ccccc23)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 5/20 0.58
▸ ABCG2 Q9UNQ0 1/20 0.58
▸ HTT P42858 4/20 0.57
▸ TSHR P16473 2/20 0.57
▸ LDHA P00338 1/20 0.56
▸ PIK3CD O00329 1/20 0.55
▸ PIK3R1 P27986 1/20 0.55
▸ LMNA P02545 3/20 0.48
▸ MAPK1 P28482 2/20 0.48
▸ APP P05067 2/20 0.48
▸ ALDH1A1 P00352 2/20 0.47
▸ CYP1A2 P05177 2/20 0.47
▸ CYP3A4 P08684 2/20 0.47
▸ CYP2D6 P10635 2/20 0.47
▸ CYP2C19 P33261 2/20 0.47
▸ HSD17B10 Q99714 2/20 0.47
▸ CLK4 Q9HAZ1 2/20 0.47
▸ ALOX15 P16050 1/20 0.47
▸ SMN1; SMN2 Q16637 2/20 0.46
▸ GAA P10253 1/20 0.46

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
SCHEMBL11260593 0.82 PIK3CD (0.71) EGFRABCG2HTTTSHRLDHA
SCHEMBL11254853 0.82 LDHA (0.67) EGFRABCG2HTTTSHRLDHA
SCHEMBL11249694 0.82 LDHA (0.64) EGFRABCG2HTTTSHRLDHA
SCHEMBL11257318 0.82 PIK3CD (0.72) EGFRHTTLDHAPIK3CDPIK3R1
SCHEMBL28699733 0.79 LDHA (0.56) EGFRABCG2HTTTSHRLDHA
SCHEMBL11255679 0.79 LMNA (0.59) EGFRABCG2HTTLDHAPIK3CD
SCHEMBL11252948 0.79 PIK3CD (0.67) EGFRABCG2HTTLDHAPIK3CD
SCHEMBL11246622 0.79 PIK3CD (0.66) EGFRHTTTSHRLDHAPIK3CD
SCHEMBL9430554 0.78 EGFR (0.69) EGFRABCG2HTTTSHRLMNA
SCHEMBL9609189 0.78 EGFR (0.47) EGFRABCG2HTTTSHRLDHA

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-4323680-A 4-Aminoquinazoline compounds useful as agricultural fungicides SANKYO COMPANY LIMITED (JP) 1982-04-06 — — US disclosed
US-4213987-A 4-AMINOQUINAZOLINES SANKYO COMPANY LIMITED (JP) 1980-07-22 — — US disclosed
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