SCHEMBL7976680

SCHEMBL7976680

BrCCCCCc1ccc[nH]1

nearest known ligand 0.40

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 2/20 0.38
MAOA P21397 1/20 0.33
DRD2 P14416 1/20 0.32
DRD4 P21917 1/20 0.32
DRD3 P35462 1/20 0.32
HRH3 Q9Y5N1 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
Ammonia Solution, Strong SCHEMBL28668347 0.98 GPR84 (0.37) GPR84MAOADRD2DRD4DRD3
SCHEMBL3145124 0.98 GPR84 (0.35) GPR84MAOADRD2DRD4DRD3
SCHEMBL536114 0.91
SCHEMBL7966661 0.91 GPR84 (0.40) GPR84MAOAHRH3
SCHEMBL8955030 0.89 GPR84 (0.44) GPR84MAOADRD2DRD4DRD3
SCHEMBL7003873 0.87 GPR84 (0.41) GPR84MAOADRD2DRD4DRD3
SCHEMBL536264 0.82
SCHEMBL25406384 0.79 DAO (0.39) GPR84MAOA
SCHEMBL16135390 0.79 GPR84 (0.59) GPR84
SCHEMBL7575666 0.79 GPR84 (0.59) GPR84

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-2001083447-A2 A HALOPYRROLE LIGAND FOR USE IN A CATALYST SYSTEM SASOL TECHNOLOGY (PTY) LTD (ZA) 2001-11-08 WO disclosed