SCHEMBL29648000

SCHEMBL29648000

NN1CCCC1c1nccc(Br)n1

nearest known ligand 0.38

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 3/20 0.31
HRH3 Q9Y5N1 1/20 0.30

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
SCHEMBL587757 0.71 CYP17A1 (0.35)
SCHEMBL6344810 0.67 CXCR4 (0.42)
SCHEMBL6644584 0.63 PARP1 (0.49)
SCHEMBL2250944 0.62 CHRNB2 (0.60)
SCHEMBL19582849 0.62 CHRNA7 (0.67)
SCHEMBL13162974 0.62 CXCR4 (0.43)
SCHEMBL421266 0.61 ACHE (0.46)
SCHEMBL7019990 0.60 ACHE (0.45)
SCHEMBL20742561 0.58 CPT1A (0.36)
SCHEMBL12182488 0.58 CHRNA7 (0.68)

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
EP-3999498-A1 INHIBITORS OF CYCLIN-DEPENDENT KINASES Kinnate Biopharma Inc. (US) 2022-05-25 EP disclosed