SCHEMBL26535296

SCHEMBL26535296

COc1ccc(CC(=O)Nc2ccc(-c3ncnc4cc(OCC5CCN(C)CC5)c(OC)cc34)cc2)cn1

nearest known ligand 0.54

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 12/20 0.54
▸ KDR P35968 4/20 0.52
▸ KIT P10721 4/20 0.52

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
SCHEMBL31137783 1.00 EGFR (0.54) EGFRKDRKIT
SCHEMBL30891753 0.93 KIT (0.47) EGFRKDRKIT
SCHEMBL26535333 0.93 KIT (0.47) EGFRKDRKIT
SCHEMBL26535443 0.92 PDGFRB (0.47) EGFRKDRKIT
SCHEMBL30891776 0.92 PDGFRB (0.47) EGFRKDRKIT
SCHEMBL30394725 0.90 KDR (0.52) EGFRKDRKIT
SCHEMBL29238265 0.90 KDR (0.52) EGFRKDRKIT
SCHEMBL26535380 0.88 KIT (0.46) KDRKIT
SCHEMBL30891757 0.88 KIT (0.46) KDRKIT
SCHEMBL29238264 0.88 KDR (0.53) EGFRKDRKIT

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-118201909-A Quinazoline derivative compound and use thereof 株式会社沃若诺伊 2024-06-14 — — CN claimed
Send feedback