SCHEMBL15965486

SCHEMBL15965486

CCOC(=O)c1cc(N(c2ccc(I)cc2)c2ccc(I)cc2)ccc1OCCOCCOCCOC

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FDPS P14324 1/20 0.37
▸ LMNA P02545 5/20 0.36
▸ MAPT P10636 4/20 0.36
▸ ALDH1A1 P00352 4/20 0.36
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ KDM4E B2RXH2 2/20 0.36
▸ CA12 O43570 1/20 0.36
▸ CA1 P00915 1/20 0.36
▸ CA2 P00918 1/20 0.36
▸ CA7 P43166 1/20 0.36
▸ CA9 Q16790 1/20 0.36
▸ CA14 Q9ULX7 1/20 0.36
▸ TSHR P16473 2/20 0.35
▸ POLB P06746 1/20 0.35
▸ L3MBTL1 Q9Y468 2/20 0.35
▸ SYK P43405 1/20 0.35
▸ KMT2A Q03164 2/20 0.34
▸ PTK2B Q14289 1/20 0.34
▸ CDC25B P30305 1/20 0.34
▸ TBXAS1 P24557 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
SCHEMBL15965483 0.91 ALDH1A1 (0.40) FDPSLMNAMAPTALDH1A1SMN1; SMN2
SCHEMBL15965472 0.91 ALDH1A1 (0.40) LMNAMAPTALDH1A1SMN1; SMN2KDM4E
SCHEMBL15965484 0.90 HTT (0.39) FDPSLMNAMAPTALDH1A1SMN1; SMN2
SCHEMBL15965494 0.90 ALDH1A1 (0.43) FDPSLMNAMAPTALDH1A1SMN1; SMN2
SCHEMBL15965487 0.89 MAPK1 (0.40) FDPSLMNAMAPTALDH1A1SMN1; SMN2
SCHEMBL23882961 0.88 FDPS (0.41) FDPSLMNAMAPTALDH1A1SMN1; SMN2
SCHEMBL15965488 0.87 ALDH1A1 (0.40) LMNAMAPTALDH1A1SMN1; SMN2KDM4E
SCHEMBL15965491 0.83 MAPT (0.44) LMNAMAPTALDH1A1SMN1; SMN2KDM4E
SCHEMBL15965493 0.82 DGAT1 (0.34) FDPSLMNAMAPTALDH1A1SMN1; SMN2
SCHEMBL15965485 0.82 TNFRSF1A (0.40) MAPTALDH1A1KDM4EL3MBTL1KMT2A

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
US-9520569-B2 Aryl compounds for application in a highly polar solvent SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-12-13 — — US disclosed
US-20140231717-A1 COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-08-21 — — US disclosed
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