SCHEMBL30613668

SCHEMBL30613668

CC(C)(C)OC(=O)N1CCO[C@H](COc2cc(-c3ccc(C(C)(C)C)s3)cc3ncccc23)C1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ EPHA2 P29317 6/20 0.48
▸ EPHB4 P54760 2/20 0.47
▸ ERBB2 P04626 1/20 0.47
▸ BUB1 O43683 1/20 0.40
▸ RET P07949 2/20 0.39
▸ P2RX3 P56373 3/20 0.39
▸ P2RX2 Q9UBL9 3/20 0.39
▸ SYK P43405 5/20 0.39
▸ IRAK4 Q9NWZ3 1/20 0.38
▸ KDR P35968 1/20 0.37
▸ ACKR3 P25106 1/20 0.37
▸ DTYMK P23919 1/20 0.37

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
SCHEMBL30613661 1.00 EPHA2 (0.48) EPHA2EPHB4ERBB2BUB1RET
SCHEMBL26135698 0.91 EPHA2 (0.40) EPHA2EPHB4ERBB2SYKIRAK4
SCHEMBL30613657 0.85 EPHA2 (0.46) EPHA2EPHB4ERBB2BUB1RET
SCHEMBL30613703 0.84 EPHA2 (0.58) EPHA2EPHB4ERBB2BUB1RET
SCHEMBL30613693 0.82 EPHA2 (0.46) EPHA2EPHB4ERBB2BUB1RET
SCHEMBL30613620 0.81 EPHA2 (0.46) EPHA2EPHB4ERBB2BUB1RET
SCHEMBL30613621 0.81 EPHA2 (0.46) EPHA2EPHB4ERBB2BUB1RET
SCHEMBL30613625 0.79 EPHA2 (0.49) EPHA2EPHB4ERBB2BUB1RET
SCHEMBL31676480 0.78 SYK (0.45) EPHA2SYKIRAK4
SCHEMBL13482977 0.75 EPHA2 (0.54) EPHA2EPHB4ERBB2BUB1P2RX3

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
EP-4504724-A1 SPLEEN TYROSINE KINASE INHIBITORS Uniquest Pty Limited (AU) 2025-02-12 — — EP disclosed
WO-2023193054-A1 SPLEEN TYROSINE KINASE INHIBITORS UNIQUEST PTY LTD (AU) 2023-10-12 — — WO disclosed
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