SCHEMBL30813371

SCHEMBL30813371

CC(C)(C)OC(=O)N1CCC(n2cc(B3OC(C)(C)C(C)(C)O3)c3c(N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)ncnc32)CC1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ SRC P12931 5/20 0.44
▸ EGFR P00533 3/20 0.44
▸ ABL1 P00519 2/20 0.41
▸ ABL2 P42684 2/20 0.41
▸ USP30 Q70CQ3 2/20 0.40
▸ CYP3A4 P08684 2/20 0.37
▸ GPR119 Q8TDV5 8/20 0.36
▸ CYP2C9 P11712 1/20 0.36
▸ HCAR1 Q9BXC0 1/20 0.36
▸ PIK3CD O00329 1/20 0.35
▸ PRKCG P05129 1/20 0.34
▸ PRKCB P05771 1/20 0.34
▸ PRKCA P17252 1/20 0.34
▸ PRKCH P24723 1/20 0.34
▸ PRKCE Q02156 1/20 0.34
▸ PRKCD Q05655 1/20 0.34

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
SCHEMBL27218035 1.00 SRC (0.44) SRCEGFRABL1ABL2USP30
SCHEMBL21221307 0.92 USP30 (0.39) SRCEGFRABL1ABL2USP30
SCHEMBL30813401 0.91 USP30 (0.38) SRCEGFRABL1ABL2USP30
SCHEMBL30813501 0.89 USP30 (0.36) SRCEGFRABL1ABL2USP30
SCHEMBL30813511 0.88 SRC (0.39) SRCEGFRABL1ABL2USP30
SCHEMBL30813509 0.87 USP30 (0.39) SRCEGFRABL1ABL2USP30
SCHEMBL27217761 0.86 USP30 (0.36) SRCEGFRABL1ABL2USP30
SCHEMBL27217808 0.85 SRC (0.35) SRCEGFRABL1ABL2USP30
SCHEMBL27218001 0.85 SRC (0.39) SRCEGFRABL1ABL2USP30
SCHEMBL27217649 0.83 USP30 (0.38) SRCEGFRUSP30

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
WO-2024059200-A1 NEK7 INHIBITORS Halia Therapeutics, Inc. (US) 2024-03-21 — — WO disclosed
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