SCHEMBL23329503

SCHEMBL23329503

NC1CC(c2ccc(Br)nc2F)C1

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 4/20 0.36
KDM1B Q8NB78 3/20 0.36
KCNH2 Q12809 2/20 0.36
PIM2 Q9P1W9 2/20 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
SCHEMBL24664640 0.81 NOTUM (0.30)
SCHEMBL30817004 0.81 NOTUM (0.30)
SCHEMBL23300656 0.79 CHRNB2 (0.36) KCNH2PIM2
Hydrochloric Acid SCHEMBL28823323 0.77 CHRNB2 (0.36) KDM1AKCNH2PIM2
SCHEMBL23328809 0.68 KDM1A (0.42) KDM1A
SCHEMBL23329038 0.66
SCHEMBL23329035 0.66 MAOB (0.31)
SCHEMBL23328842 0.65
Hydrochloric Acid SCHEMBL28949069 0.65
Hydrochloric Acid SCHEMBL28949067 0.65

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-2021083011-A1 BRIDGED CYCLOFORMYLPYRIDINE DERIVATIVE AND USE THEREOF 北京伯汇生物技术有限公司 2021-05-06 WO disclosed