SCHEMBL28260583

SCHEMBL28260583

C1=Cc2ccccc2OC1.[BiH3].[Ni]

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2B6 P20813 3/20 0.42
STS P08842 1/20 0.41
ABCG2 Q9UNQ0 1/20 0.39
ITGB2 P05107 1/20 0.39
ICAM1 P05362 1/20 0.39
ITGAL P20701 1/20 0.39
CA1 P00915 1/20 0.36
CA9 Q16790 1/20 0.36
LMNA P02545 2/20 0.34
CRHBP P24387 2/20 0.34
CRHR2 Q13324 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
HTT P42858 1/20 0.34
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 1/20 0.34
ALDH1A1 P00352 1/20 0.34
MAPT P10636 1/20 0.34
KMT2A Q03164 1/20 0.34
HTR2C P28335 1/20 0.34
HTR2B P41595 1/20 0.34

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
SCHEMBL82421 1.00 CYP2B6 (0.42) CYP2B6STSABCG2ITGB2ICAM1
SCHEMBL29687375 1.00 CYP2B6 (0.42) CYP2B6STSABCG2ITGB2ICAM1
SCHEMBL322176 0.98 CYP2B6 (0.41) CYP2B6STSABCG2ITGB2ICAM1
SCHEMBL11219896 0.98 CYP2B6 (0.41) CYP2B6STSABCG2ITGB2ICAM1
Methane SCHEMBL13860536 0.98 CYP2B6 (0.41) CYP2B6STSABCG2ITGB2ICAM1
SCHEMBL2514486 0.98 CYP2B6 (0.41) CYP2B6STSABCG2ITGB2ICAM1
SCHEMBL1447323 0.98 CYP2B6 (0.41) CYP2B6STSABCG2ITGB2ICAM1
SCHEMBL21056419 0.98 CYP2B6 (0.41) CYP2B6STSABCG2ITGB2ICAM1
SCHEMBL21056420 0.98 CYP2B6 (0.41) CYP2B6STSABCG2ITGB2ICAM1
SCHEMBL130348 0.98 CYP2B6 (0.41) CYP2B6STSABCG2ITGB2ICAM1

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
CN-109155193-A Generator 电力转换有限公司 2019-01-04 CN claimed
CN-109155193-A Generator 电力转换有限公司 2019-01-04 CN disclosed