SCHEMBL31039265

SCHEMBL31039265

Cc1cc(Br)cc2c1cnn2CCBr

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KMO O15229 2/20 0.35
ADORA2A P29274 2/20 0.33
ADORA2B P29275 2/20 0.33
IDO1 P14902 1/20 0.32
TDO2 P48775 1/20 0.32
PDE1A P54750 1/20 0.31
PDE1B Q01064 1/20 0.31
PDE1C Q14123 1/20 0.31
HSD17B10 Q99714 1/20 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
SCHEMBL16616905 0.83 ADORA2A (0.44) KMOADORA2AADORA2BPDE1APDE1B
SCHEMBL31039286 0.83 EGFR (0.41) KMOADORA2AADORA2BIDO1TDO2
SCHEMBL23994142 0.78 CYP17A1 (0.43) ADORA2AADORA2B
SCHEMBL29426945 0.78 IDO1 (0.43) ADORA2AADORA2BIDO1TDO2HSD17B10
SCHEMBL25411517 0.78 IDO1 (0.43) ADORA2AADORA2BIDO1TDO2HSD17B10
SCHEMBL29035700 0.70 CYP1A2 (0.35)
SCHEMBL31039261 0.67 EZH2 (0.32)
SCHEMBL2588357 0.66 KMO (0.43) KMOADORA2AADORA2BPDE1APDE1B
SCHEMBL16617143 0.66 PTGER3 (0.41) ADORA2AADORA2BPDE1APDE1BPDE1C
SCHEMBL1252516 0.66 ADORA2A (0.40) KMOADORA2AADORA2BIDO1TDO2

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
EP-4655296-A1 CBL-B INHIBITORS Aurigene Oncology Limited (IN) 2025-12-03 EP disclosed
WO-2024156938-A1 CBL-B INHIBITORS ORION CORPORATION (FI) 2024-08-02 WO disclosed