SCHEMBL25048701

SCHEMBL25048701

Cc1ncnc2c1ccn2[C@@H]1C[C@H](C(=O)NCCCNCc2cccc(Oc3ccccc3)c2)[C@@H](O)[C@H]1O

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ PRMT5 O14744 11/20 0.40
▸ FFAR1 O14842 4/20 0.36
▸ KDM4E B2RXH2 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ VHL P40337 1/20 0.35

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
SCHEMBL25048777 0.94 PRMT5 (0.41) PRMT5
SCHEMBL25047809 0.91 PRMT5 (0.41) PRMT5FFAR1
SCHEMBL31618039 0.91 PRMT5 (0.41) PRMT5FFAR1
SCHEMBL25048298 0.90 PRMT5 (0.42) PRMT5
SCHEMBL31618056 0.85 PRMT5 (0.43) PRMT5
SCHEMBL25048705 0.85 CCR8 (0.40) FFAR1KDM4EMAPK1
SCHEMBL25047461 0.82 PRMT5 (0.37) PRMT5
SCHEMBL25047840 0.82 PRMT5 (0.40) PRMT5
SCHEMBL31618015 0.81 PRMT5 (0.44) PRMT5
SCHEMBL25048301 0.75 CCR8 (0.40) PRMT5FFAR1KDM4E

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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