SCHEMBL4277928

SCHEMBL4277928

CCCCCCCC[Sn](CCCCCCCC)(CCCCCCCC)OCc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CETP P11597 3/20 0.47
DNM1 Q05193 2/20 0.42
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
MAPK1 P28482 2/20 0.41
TP53 P04637 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
EPHX2 P34913 1/20 0.41
PKM P14618 1/20 0.41
HTT P42858 2/20 0.40
KCNH2 Q12809 1/20 0.40
ALDH1A1 P00352 1/20 0.40
CYP3A4 P08684 1/20 0.40
TSHR P16473 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
SIGMAR1 Q99720 1/20 0.40

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
SCHEMBL2326268 0.93 CETP (0.42) CETPMAPK1TP53SMN1; SMN2ALDH1A1
SCHEMBL2328175 0.89 CETP (0.41) CETPMAPK1TP53SMN1; SMN2ALDH1A1
SCHEMBL2330690 0.89 CETP (0.41) CETPMAPK1TP53SMN1; SMN2ALDH1A1
SCHEMBL4268877 0.86 CETP (0.47) CETPDNM1MEN1KMT2AMAPK1
SCHEMBL2360056 0.86 CETP (0.41) CETPMAPK1TP53SMN1; SMN2ALDH1A1
SCHEMBL2323276 0.86 CETP (0.41) CETPMAPK1TP53SMN1; SMN2ALDH1A1
SCHEMBL2324169 0.86 CETP (0.47) CETPDNM1MEN1KMT2AMAPK1
SCHEMBL2697024 0.83 CETP (0.45) CETPDNM1MEN1KMT2AMAPK1
SCHEMBL2327991 0.78 CETP (0.42) CETPMAPK1TP53SMN1; SMN2ALDH1A1
SCHEMBL4270221 0.78 CETP (0.42) CETPMAPK1TP53SMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8362289-B2 Mixture for recovery utilization or transfer of carbon dioxide ASAHI KASEI CHEMICALS CORPORATION (JP) 2013-01-29 US disclosed
EP-2006013-B1 MIXTURE FOR CARBON DIOXIDE RECOVERY/UTILIZATION AND TRANSPORTATION ASAHI KASEI CHEMICALS CORP (JP) 2013-01-02 EP disclosed
EP-2006013-A9 MIXTURE FOR CARBON DIOXIDE RECOVERY/UTILIZATION AND TRANSPORTATION Asahi Kasei Chemicals Corporation (JP) 2009-07-22 EP disclosed
US-20090169461-A1 Mixture For Recovery Utilization Or Transfer Of Carbon Dioxide ASAHI KASEI KABUSHIKI KAISHA (JP) 2009-07-02 US disclosed
EP-2006013-A2 MIXTURE FOR CARBON DIOXIDE RECOVERY/UTILIZATION AND TRANSPORTATION Asahi Kasei Chemicals Corporation (JP) 2008-12-24 EP disclosed