SCHEMBL25047629

SCHEMBL25047629

Cc1ccc(CCN(CCCN(C[C@@H]2CC[C@H](n3cc(-c4nccs4)c4c(N)ncnc43)C2)c2cn[nH]c2)C(=O)OC(C)(C)C)cc1

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ SRC P12931 18/20 0.34
▸ EGFR P00533 1/20 0.34
▸ RIPK2 O43353 1/20 0.34
▸ ADK P55263 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
SCHEMBL25049087 0.86 RIPK2 (0.36) SRCEGFRRIPK2ADK
SCHEMBL25047620 0.86 MEN1 (0.38) SRCEGFRRIPK2ADK
SCHEMBL25048992 0.83 MEN1 (0.34) SRCEGFRRIPK2
SCHEMBL31618083 0.81 ADK (0.32) ADK
SCHEMBL25048524 0.79 ADK (0.40) SRCEGFRADK
SCHEMBL25049062 0.78 SRC (0.37) SRCEGFRRIPK2
SCHEMBL25048240 0.78 HTR4 (0.31) —
SCHEMBL25047619 0.78 — —
SCHEMBL25048412 0.76 HCRTR1 (0.30) —
SCHEMBL25047493 0.76 SRC (0.54) SRCEGFRRIPK2

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-2023017152-A1 SPECIFIC SMALL MOLECULE INHIBITORS THAT BLOCK KMT9 METHYLTRANSFERASE ACTIVITY AND FUNCTION ALBERT-LUDWIGS-UNIVERSITÄT FREIBURG (DE) 2023-02-16 — — WO disclosed
Send feedback