SCHEMBL30449685

SCHEMBL30449685

OC1CCCc2c1ccn2-c1cc(F)cc(F)c1

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.34
UGT2B17 O75795 2/20 0.33
KMT2A Q03164 2/20 0.32
MEN1 O00255 1/20 0.32
TTR P02766 1/20 0.32
PGR P06401 1/20 0.32
HTR6 P50406 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
SCHEMBL30491068 0.87 UGT2B17 (0.33) UGT2B17PGR
SCHEMBL25250060 0.75 ARNT (0.34)
SCHEMBL25800558 0.71 UGT2B17 (0.35) ATMUGT2B17KMT2A
SCHEMBL24109939 0.70 EPAS1 (0.45) ATM
SCHEMBL16363088 0.69 UGT2B17 (0.40) UGT2B17KMT2APGR
SCHEMBL19594331 0.69 UGT2B17 (0.40) UGT2B17KMT2APGR
SCHEMBL16363075 0.69 UGT2B17 (0.40) UGT2B17KMT2APGR
SCHEMBL24110119 0.69 EPAS1 (0.42) ATMPGR
SCHEMBL28980658 0.68 EPAS1 (0.40)
SCHEMBL30449427 0.68 EPAS1 (0.40)

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
CN-115884966-A Bicyclic compounds and uses thereof 贝达药业股份有限公司 2023-03-31 CN claimed