SCHEMBL26099835

SCHEMBL26099835

CCN1CCC(COc2cc3ncnc(-c4ccc(C(C(N)=O)c5ccc(C(F)(F)F)c(F)c5)cc4)c3cc2OC)CC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 11/20 0.40
▸ RET P07949 2/20 0.40
▸ KIF5B P33176 2/20 0.40
▸ EGFR P00533 11/20 0.40
▸ FGFR1 P11362 8/20 0.40
▸ FLT1 P17948 8/20 0.40
▸ FLT4 P35916 8/20 0.40
▸ KIT P10721 5/20 0.40
▸ PDGFRB P09619 2/20 0.40
▸ TEK Q02763 2/20 0.40
▸ EPHA2 P29317 2/20 0.40
▸ EPHB4 P54760 2/20 0.40
▸ BMPR1B O00238 1/20 0.40
▸ PLK4 O00444 1/20 0.40
▸ CIT O14578 1/20 0.40
▸ GAK O14976 1/20 0.40
▸ EPHB6 O15197 1/20 0.40
▸ RIPK2 O43353 1/20 0.40
▸ ROCK2 O75116 1/20 0.40
▸ STK10 O94804 1/20 0.40

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
SCHEMBL30891778 0.91 MAPK7 (0.45) KDRRETKIF5BEGFRFGFR1
SCHEMBL26099862 0.91 MAPK7 (0.45) KDRRETKIF5BEGFRFGFR1
SCHEMBL26102800 0.89 HTR1A (0.45) KDREGFRKITAURKBENPP1
SCHEMBL26101314 0.88 KIT (0.42) KDRRETKIF5BEGFRFGFR1
SCHEMBL26103463 0.87 MAPK7 (0.44) KDREGFRFLT1KITEPHA2
SCHEMBL30394062 0.84 EGFR (0.49) KDRRETKIF5BEGFRFGFR1
SCHEMBL26101933 0.84 EGFR (0.49) KDRRETKIF5BEGFRFGFR1
SCHEMBL26101193 0.83 MAPK7 (0.43) KDREGFRFGFR1FLT1FLT4
SCHEMBL26101421 0.83 MAPK7 (0.43) KDREGFRFGFR1FLT1FLT4
SCHEMBL26100179 0.83 KIT (0.44) KDRRETKIF5BEGFRFGFR1

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
WO-2023075529-A1 QUINAZOLINE DERIVATIVE COMPOUND AND USE THEREOF 보로노이바이오 주식회사 2023-05-04 — — WO claimed
WO-2023075529-A1 QUINAZOLINE DERIVATIVE COMPOUND AND USE THEREOF 보로노이바이오 주식회사 2023-05-04 — — WO disclosed
Send feedback