SCHEMBL31424693

SCHEMBL31424693

Cc1nc2c(Oc3ccccc3)cc(CBr)cc2[nH]c1=O

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GRIN1 Q05586 7/20 0.37
GRIN2B Q13224 7/20 0.37
PDE10A Q9Y233 1/20 0.36
TTR P02766 1/20 0.36
POLB P06746 2/20 0.36
ALOX15 P16050 1/20 0.36
NTRK1 P04629 1/20 0.36
IGF1R P08069 1/20 0.36
FGFR1 P11362 1/20 0.36
NTRK2 Q16620 1/20 0.36
BRD4 O60885 3/20 0.35
DHODH Q02127 2/20 0.35
RHEB Q15382 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
SCHEMBL31424682 1.00 GRIN1 (0.37) GRIN1GRIN2BPDE10ATTRPOLB
SCHEMBL31424694 0.89 PDE10A (0.36) PDE10ABRD4DHODH
SCHEMBL31424637 0.88 BRD4 (0.44) BRD4
SCHEMBL31424869 0.88 RHEB (0.42) GRIN1GRIN2BTTRPOLBALOX15
SCHEMBL31424670 0.88 SLC6A2 (0.36) BRD4
SCHEMBL31424745 0.85 GRIN1 (0.39) GRIN1GRIN2BDHODH
SCHEMBL31424629 0.85 BRD4 (0.40) BRD4
SCHEMBL31424666 0.84 SLC6A4 (0.38) GRIN1GRIN2BPOLBALOX15NTRK1
SCHEMBL31424746 0.80 MAPT (0.38) PDE10A
SCHEMBL31424697 0.79 MAPK1 (0.36) GRIN1GRIN2BPOLB

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120020129-A Substituted nitrogen-containing bicyclic compounds and uses thereof 广东东阳光药业股份有限公司 2025-05-20 CN disclosed
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