SCHEMBL26645256

SCHEMBL26645256

Cc1cc(-c2nn3c(c2Br)CN(C(=O)OC(C)(C)C)CC3)ccc1Cl

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ ESR2 Q92731 1/20 0.38
▸ CSNK1E P49674 6/20 0.38
▸ LMNA P02545 1/20 0.37
▸ CNR1 P21554 1/20 0.37
▸ CNR2 P34972 1/20 0.37
▸ CSNK1D P48730 5/20 0.36
▸ POLB P06746 1/20 0.36
▸ CTSS P25774 1/20 0.36
▸ GPR119 Q8TDV5 1/20 0.36
▸ F12 P00748 1/20 0.36
▸ SUV39H2 Q9H5I1 1/20 0.36

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
SCHEMBL30622773 0.92 MEN1 (0.37) MEN1KMT2AESR2CSNK1ECNR1
SCHEMBL26645726 0.87 MEN1 (0.46) MEN1KMT2AESR2CSNK1ECNR1
SCHEMBL26645805 0.85 CSNK1E (0.42) MEN1KMT2AESR2CSNK1ECNR1
SCHEMBL24277111 0.85 CSNK1E (0.41) ESR2CSNK1ELMNACSNK1DF12
SCHEMBL17382842 0.83 CSNK1E (0.52) CSNK1ECSNK1D
SCHEMBL17129177 0.81 CSNK1D (0.51) CSNK1ECSNK1DPOLBGPR119
SCHEMBL26645904 0.81 CSNK1E (0.55) CSNK1ECSNK1D
SCHEMBL30622973 0.81 GRM5 (0.41) MEN1KMT2ACSNK1ECNR1CNR2
SCHEMBL26645271 0.80 CSNK1E (0.46) MEN1KMT2ACSNK1ECSNK1D
SCHEMBL16728627 0.80 CSNK1E (0.56) CSNK1ECSNK1D

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-4519265-A1 IRREVERSIBLE MUTEGFR INHIBITORS Bayer Aktiengesellschaft (DE) 2025-03-12 — — EP disclosed
WO-2023213882-A1 IRREVERSIBLE MUTEGFR INHIBITORS BAYER AKTIENGESELLSCHAFT (DE) 2023-11-09 — — WO disclosed
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