SCHEMBL30622773

SCHEMBL30622773

Cc1cc(-c2cc3n(n2)CCN(C(=O)OC(C)(C)C)C3)ccc1Cl.Cc1cc(-c2nn3c(c2Br)CN(C(=O)OC(C)(C)C)CC3)ccc1Cl

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ GRM5 P41594 7/20 0.37
▸ CSNK1E P49674 4/20 0.35
▸ NR1H2 P55055 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ CSNK1D P48730 2/20 0.34
▸ CNR1 P21554 1/20 0.33
▸ CNR2 P34972 1/20 0.33
▸ CYBB P04839 1/20 0.33
▸ NOX5 Q96PH1 1/20 0.33
▸ NOX4 Q9NPH5 1/20 0.33
▸ NOX1 Q9Y5S8 1/20 0.33
▸ ESR2 Q92731 1/20 0.33
▸ CTSS P25774 1/20 0.33

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
SCHEMBL26645256 0.92 MEN1 (0.40) MEN1KMT2ACSNK1EPOLBCSNK1D
SCHEMBL26645489 0.89 MEN1 (0.44) MEN1KMT2AGRM5NR1H2POLB
SCHEMBL30622973 0.88 GRM5 (0.41) MEN1KMT2AGRM5CSNK1ENR1H2
SCHEMBL30623007 0.88 MEN1 (0.41) MEN1KMT2AGRM5NR1H2POLB
SCHEMBL30622765 0.84 CSNK1E (0.44) GRM5CSNK1ECSNK1D
SCHEMBL30623123 0.83 GRM5 (0.43) GRM5CSNK1ENR1H2CSNK1D
SCHEMBL26645758 0.81 GRM5 (0.43) MEN1KMT2AGRM5NR1H2POLB
SCHEMBL26645726 0.80 MEN1 (0.46) MEN1KMT2ACSNK1EPOLBCSNK1D
SCHEMBL26645805 0.78 CSNK1E (0.42) MEN1KMT2ACSNK1EPOLBCSNK1D
SCHEMBL24277111 0.78 CSNK1E (0.41) CSNK1ECSNK1DESR2

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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