SCHEMBL28673063

SCHEMBL28673063

CC(COc1ncc(Cl)cc1F)Nc1ncnc2ccccc12

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 7/20 0.46
▸ GALR3 O60755 1/20 0.45
▸ NR2F2 P24468 1/20 0.45
▸ TP53 P04637 1/20 0.42
▸ PIK3CA P42336 1/20 0.42
▸ GBA1 P04062 1/20 0.41
▸ FADS1 O60427 1/20 0.41
▸ LCK P06239 1/20 0.40
▸ KMT2A Q03164 3/20 0.40
▸ NPC1 O15118 2/20 0.40
▸ RAB9A P51151 2/20 0.40
▸ MEN1 O00255 2/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ HTT P42858 1/20 0.40
▸ LDHA P00338 1/20 0.39
▸ ABCG2 Q9UNQ0 1/20 0.39
▸ MAPT P10636 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ DYRK1A Q13627 1/20 0.38

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
SCHEMBL29898270 1.00 EGFR (0.46) EGFRGALR3NR2F2TP53PIK3CA
SCHEMBL28690718 0.84 KDR (0.53) EGFR
SCHEMBL29898311 0.84 KDR (0.53) EGFR
SCHEMBL28689155 0.81 HPGD (0.47) EGFRGALR3NR2F2GBA1RAB9A
SCHEMBL29898273 0.81 HPGD (0.47) EGFRGALR3NR2F2GBA1RAB9A
SCHEMBL11248882 0.79 EGFR (0.52) EGFRGALR3NR2F2GBA1FADS1
SCHEMBL28767096 0.79 KDM4E (0.34) TP53KMT2ANPC1RAB9AMEN1
SCHEMBL28696670 0.79 NR2F2 (0.46) EGFRGALR3NR2F2TP53GBA1
SCHEMBL29898285 0.79 NR2F2 (0.46) EGFRGALR3NR2F2TP53GBA1
SCHEMBL11261278 0.79 EGFR (0.52) EGFRGALR3NR2F2TP53GBA1

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
CN-113754636-B Quinazoline-containing aza-ether compounds 湖南化工研究院有限公司 2022-10-04 — — CN claimed
CN-113754636-A Quinazoline-containing aza-ether compounds 湖南化工研究院有限公司 2021-12-07 — — CN claimed
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