SCHEMBL9808186

SCHEMBL9808186

C=COCCOc1cc(C(C)(C)C)c(OCCOC=C)cc1C(C)(C)C

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 6/20 0.37
▸ MAPK1 P28482 3/20 0.37
▸ HTT P42858 3/20 0.37
▸ ALDH1A1 P00352 3/20 0.36
▸ GAA P10253 2/20 0.36
▸ KDM4E B2RXH2 7/20 0.36
▸ KMT2A Q03164 4/20 0.36
▸ NPSR1 Q6W5P4 3/20 0.36
▸ MEN1 O00255 3/20 0.36
▸ TP53 P04637 1/20 0.35
▸ CYP3A4 P08684 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ ALOX15 P16050 1/20 0.35
▸ HTR2A P28223 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ SMN1; SMN2 Q16637 2/20 0.32
▸ CYP1A2 P05177 1/20 0.31
▸ CYP2D6 P10635 1/20 0.31
▸ CYP2C19 P33261 1/20 0.31

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
SCHEMBL9808116 0.84 LMNA (0.41) LMNAMAPK1HTTALDH1A1GAA
SCHEMBL9978253 0.80 LMNA (0.47) LMNAMAPK1HTTALDH1A1GAA
SCHEMBL19996379 0.79 KDM4E (0.39) LMNAMAPK1HTTALDH1A1GAA
SCHEMBL19996380 0.78 KDM4E (0.41) LMNAMAPK1HTTALDH1A1GAA
SCHEMBL9988593 0.76 KDM4E (0.45) LMNAMAPK1HTTALDH1A1GAA
SCHEMBL29825060 0.76 LMNA (0.53) LMNAMAPK1HTTALDH1A1GAA
SCHEMBL9980397 0.76 KDM4E (0.45) LMNAMAPK1HTTALDH1A1GAA
SCHEMBL16008090 0.76 LMNA (0.53) LMNAMAPK1HTTALDH1A1GAA
SCHEMBL9988607 0.76 KDM4E (0.45) LMNAMAPK1HTTALDH1A1GAA
SCHEMBL683412 0.75 ALDH1A1 (0.42) LMNAHTTALDH1A1GAAKDM4E

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-4985393-A Bis/hydroxyphenylthio/ Compounds KANZAKI PAPER MANUFACTURING CO., LTD. (JP) 1991-01-15 — — US disclosed
EP-0373561-A2 Heat sensitive recording material KANZAKI PAPER MANUFACTURING CO., LTD. (JP) 1990-06-20 — — EP disclosed
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