SCHEMBL25049159

SCHEMBL25049159

Clc1ncnc2c1ccn2C1CCC(c2cccc(-c3cnsc3)c2)C1

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PIP4K2A P48426 1/20 0.34
▸ KDR P35968 1/20 0.33
▸ PRMT5 O14744 1/20 0.32
▸ WDR77 Q9BQA1 1/20 0.32
▸ NNMT P40261 2/20 0.31
▸ RIPK2 O43353 1/20 0.31

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
SCHEMBL25046757 0.89 PRMT5 (0.38) PRMT5WDR77RIPK2
SCHEMBL25048176 0.89 KDR (0.31) KDR
SCHEMBL25049069 0.83 CHKA (0.33) KDR
SCHEMBL25048447 0.82 PIP4K2A (0.37) PIP4K2APRMT5WDR77NNMT
SCHEMBL25047425 0.82 PIP4K2A (0.39) PIP4K2APRMT5WDR77NNMTRIPK2
SCHEMBL25048961 0.78 DRD2 (0.40) PIP4K2APRMT5WDR77NNMT
SCHEMBL30941334 0.75 PRMT5 (0.33) PRMT5WDR77NNMT
SCHEMBL25046708 0.75 PRMT5 (0.47) PRMT5WDR77
SCHEMBL25048722 0.74 PIP4K2A (0.39) PIP4K2APRMT5WDR77NNMT
SCHEMBL25048281 0.74 PRMT5 (0.37) PRMT5WDR77

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
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