SCHEMBL24714632

SCHEMBL24714632

COc1cc2ncnc(Nc3cc(-c4ccco4)ccc3OC)c2cc1NC(=O)/C=C/C1CCCN1C

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
EGFR P00533 17/20 0.56
ERBB2 P04626 16/20 0.52
JAK3 P52333 1/20 0.47
ERBB4 Q15303 1/20 0.47

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
SCHEMBL30822063 1.00 EGFR (0.56) EGFRERBB2JAK3ERBB4
SCHEMBL27145363 1.00 EGFR (0.56) EGFRERBB2JAK3ERBB4
SCHEMBL30031665 0.88 EGFR (0.52) EGFRERBB2JAK3ERBB4
SCHEMBL30031034 0.88 EGFR (0.52) EGFRERBB2JAK3ERBB4
SCHEMBL27146152 0.88 EGFR (0.52) EGFRERBB2JAK3ERBB4
SCHEMBL27152214 0.88 EGFR (0.52) EGFRERBB2JAK3ERBB4
SCHEMBL30031208 0.86 EGFR (0.54) EGFRERBB2
SCHEMBL24714644 0.86 EGFR (0.54) EGFRERBB2
SCHEMBL27136435 0.84 EGFR (0.61) EGFRERBB2JAK3ERBB4
SCHEMBL27136436 0.84 EGFR (0.61) EGFRERBB2JAK3ERBB4

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4328222-A1 HETEROARYL DERIVATIVE COMPOUND AND USE THEREOF Voronoi Inc. (KR) 2024-02-28 EP claimed
EP-4328222-A1 HETEROARYL DERIVATIVE COMPOUND AND USE THEREOF Voronoi Inc. (KR) 2024-02-28 EP disclosed
EP-4328222-A1 HETEROARYL DERIVATIVE COMPOUND AND USE THEREOF Voronoi Inc. (KR) 2024-02-28 EP disclosed
WO-2022225238-A1 HETEROARYL DERIVATIVE COMPOUND AND USE THEREOF 보로노이 주식회사 2022-10-27 WO disclosed