SCHEMBL25046693

SCHEMBL25046693

Nc1nc(Cl)nc2c1ccn2C1CCC(c2ccc(=O)[nH]c2)C1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ CHKA P35790 2/20 0.33
▸ NT5E P21589 1/20 0.31
▸ PRMT5 O14744 1/20 0.30
▸ TRPV6 Q9H1D0 2/20 0.30

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
SCHEMBL25048095 0.90 PARP1 (0.32) TRPV6
SCHEMBL25048458 0.85 CHKA (0.34) CHKANT5EPRMT5
SCHEMBL25048345 0.82 CHKA (0.35) CHKANT5E
SCHEMBL25048059 0.81 CHKA (0.32) CHKANT5E
SCHEMBL25046781 0.79 CHKA (0.38) CHKA
SCHEMBL25046819 0.78 PRMT5 (0.40) NT5EPRMT5
SCHEMBL30941211 0.78 PRMT5 (0.40) NT5EPRMT5
SCHEMBL25047669 0.77 CHKA (0.33) CHKA
SCHEMBL25048731 0.76 PIK3CA (0.36) CHKATRPV6
SCHEMBL25049274 0.75 CHKA (0.35) CHKANT5EPRMT5

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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