SCHEMBL29612259

SCHEMBL29612259

ClC1(Cl)c2ccccc2-c2ccccc21

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S100A4 P26447 1/20 0.65
PDK2 Q15119 6/20 0.44
THRB P10828 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
KDM4E B2RXH2 2/20 0.41
LMNA P02545 2/20 0.41
MAPT P10636 2/20 0.41
KMT2A Q03164 2/20 0.41
MEN1 O00255 1/20 0.41
OPRK1 P41145 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ITGA4 P13612 1/20 0.38
APEX1 P27695 1/20 0.37
ALDH1A1 P00352 2/20 0.36
CACNA1B Q00975 2/20 0.36
HSP90AA1 P07900 1/20 0.36
HSP90AB1 P08238 1/20 0.36
CACNB4 O00305 1/20 0.36
CACNA1A O00555 1/20 0.36
CACNA1G O43497 1/20 0.36

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
SCHEMBL6836847 1.00 S100A4 (0.65) S100A4PDK2THRBTDP1KDM4E
SCHEMBL27500046 0.97 S100A4 (0.62) S100A4PDK2THRBTDP1KDM4E
SCHEMBL28216738 0.97 S100A4 (0.62) S100A4PDK2THRBTDP1KDM4E
SCHEMBL9126309 0.84 S100A4 (0.61) S100A4THRBKDM4ELMNAMAPT
SCHEMBL8369793 0.83 S100A4 (0.46) S100A4PDK2THRBTDP1LMNA
SCHEMBL15745345 0.82 S100A4 (0.54) S100A4PDK2THRBTDP1KDM4E
SCHEMBL28469207 0.82 S100A4 (0.54) S100A4PDK2THRBTDP1KDM4E
SCHEMBL9270796 0.82 PDK2 (0.56) S100A4PDK2
Ammonia Solution, Strong SCHEMBL9520970 0.80 S100A4 (0.44) S100A4PDK2TDP1LMNAALDH1A1
SCHEMBL2599169 0.80 S100A4 (1.00) S100A4PDK2THRBTDP1KDM4E

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115745761-B Preparation method of high-quality 9-fluorenone 中唯炼焦技术国家工程研究中心有限责任公司 2024-02-13 CN disclosed
CN-115745761-A Preparation method of high-quality 9-fluorenone 中唯炼焦技术国家工程研究中心有限责任公司 2023-03-07 CN disclosed
CN-110002986-B Method for synthesizing fluorenone compound by molecular oxygen oxidation in aqueous phase 郑州大学 2022-03-11 CN disclosed