SCHEMBL29951228

SCHEMBL29951228

O=Cc1c(-c2ccccc2F)nn(-c2ccccc2F)c1Br

nearest known ligand 0.42

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
KCNN4 O15554 13/20 0.42
HPGD P15428 1/20 0.33
KMT2A Q03164 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
SCHEMBL2559754 0.91 KCNN4 (0.40) KCNN4HPGDKMT2A
SCHEMBL15329947 0.90 KCNN4 (0.44) KCNN4HPGDKMT2A
SCHEMBL15329813 0.90 KCNN4 (0.44) KCNN4KMT2A
SCHEMBL2562989 0.89 KCNN4 (0.36) KCNN4
SCHEMBL2557720 0.89 TP53 (0.40) KCNN4
SCHEMBL2555494 0.89 NPC1 (0.38) KCNN4KMT2A
SCHEMBL15330668 0.89 MAPK14 (0.38) KCNN4
SCHEMBL2558756 0.87 KCNN4 (0.37) KCNN4HPGDKMT2A
SCHEMBL15329948 0.86 LMNA (0.40) KMT2A
SCHEMBL2561884 0.86 KCNN4 (0.37) KCNN4HPGDKMT2A

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
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed