SCHEMBL31424670

SCHEMBL31424670

Cc1nc2c(Oc3cccc(F)c3)cc(CBr)cc2[nH]c1=O

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 2/20 0.36
SLC6A4 P31645 2/20 0.36
SLC6A3 Q01959 2/20 0.36
BRD4 O60885 8/20 0.35
BRAF P15056 2/20 0.35
HTR1A P08908 1/20 0.34
KDM4E B2RXH2 2/20 0.34
HCAR2 Q8TDS4 1/20 0.34
TSHR P16473 1/20 0.34
GFER P55789 1/20 0.34
MAOB P27338 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
SCHEMBL31424637 0.88 BRD4 (0.44) BRD4BRAF
SCHEMBL31424682 0.88 GRIN1 (0.37) BRD4
SCHEMBL31424693 0.88 GRIN1 (0.37) BRD4
SCHEMBL31424774 0.86 BRD4 (0.36) SLC6A2SLC6A4SLC6A3BRD4BRAF
SCHEMBL31424629 0.83 BRD4 (0.40) BRD4
SCHEMBL31424694 0.82 PDE10A (0.36) BRD4BRAFKDM4E
SCHEMBL31424753 0.79 ADORA3 (0.41) BRD4KDM4ETSHRGFER
SCHEMBL31424745 0.79 GRIN1 (0.39) SLC6A4
SCHEMBL31424768 0.77 BRD4 (0.44) BRD4BRAF
SCHEMBL31424696 0.76 KDM4E (0.35) KDM4ETSHR

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
CN-119431314-A Substituted nitrogen-containing bicyclic compounds and uses thereof 广东东阳光药业股份有限公司 2025-02-14 CN disclosed