SCHEMBL25048095

SCHEMBL25048095

O=c1ccc(C2CCC(n3ccc4c(Cl)nc(Cl)nc43)C2)c[nH]1

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ PARP1 P09874 1/20 0.32
▸ TRPV6 Q9H1D0 2/20 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
SCHEMBL25046693 0.90 CHKA (0.33) TRPV6
SCHEMBL25049257 0.84 — —
SCHEMBL25048741 0.81 OPRM1 (0.38) PARP1TRPV6
SCHEMBL25049211 0.78 NPBWR1 (0.35) —
SCHEMBL25046755 0.76 PDE10A (0.32) —
SCHEMBL2173172 0.76 LRRK2 (0.36) —
SCHEMBL25048803 0.75 PIP4K2A (0.35) —
SCHEMBL25048458 0.74 CHKA (0.34) —
SCHEMBL25046765 0.73 ADRA1A (0.40) —
SCHEMBL30941144 0.73 — —

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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