SCHEMBL9356630

SCHEMBL9356630

CC(=O)Oc1cccc2c1C=CC(C)(CCC[C@H](C)CCC[C@H](C)CCCC(C)C)O2

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ PDE4A P27815 1/20 0.41
▸ PDE3A Q14432 1/20 0.41
▸ AKT1 P31749 3/20 0.36
▸ TTPA P49638 1/20 0.35
▸ ACE2 Q9BYF1 2/20 0.34
▸ PDCD1 Q15116 1/20 0.34
▸ CD274 Q9NZQ7 1/20 0.34
▸ PTPN1 P18031 1/20 0.33
▸ GSTO1 P78417 1/20 0.33
▸ ALOX5 P09917 1/20 0.33
▸ HIF1A Q16665 1/20 0.33
▸ TRPV1 Q8NER1 1/20 0.33
▸ PSEN1 P49768 2/20 0.32

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
SCHEMBL9356911 0.81 AKT1 (0.48) MEN1KMT2AAKT1TTPATRPV1
SCHEMBL16529639 0.76 MEN1 (0.61) MEN1KMT2APDE4APDE3AAKT1
SCHEMBL16530185 0.76 MEN1 (0.61) MEN1KMT2APDE4APDE3AAKT1
SCHEMBL16530089 0.76 MEN1 (0.61) MEN1KMT2APDE4APDE3AAKT1
SCHEMBL16529493 0.76 MEN1 (0.61) MEN1KMT2APDE4APDE3AAKT1
SCHEMBL16529640 0.76 MEN1 (0.61) MEN1KMT2APDE4APDE3AAKT1
SCHEMBL16529641 0.76 MEN1 (0.61) MEN1KMT2APDE4APDE3AAKT1
SCHEMBL16530184 0.76 MEN1 (0.61) MEN1KMT2APDE4APDE3AAKT1
SCHEMBL9356382 0.73 PTGS1 (0.37) MEN1KMT2APDE4APDE3AAKT1
SCHEMBL21875425 0.68 LMNA (0.43) MEN1KMT2AAKT1TTPAPTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0304842-A2 Isoprenoid derivatives and anti-ulcer agents containing the same NISSHIN FLOUR MILLING CO., LTD. (JP) 1989-03-01 — — EP claimed
EP-0304842-B1 Isoprenoid derivatives and anti-ulcer agents containing the same NISSHIN FLOUR MILLING CO (JP) 1994-11-30 — — EP disclosed
US-4906669-A Isoprenoid derivatives and anti-ulcer agents containing the same NISSHIN FLOUR MILLING CO., LTD. (JP) 1990-03-06 — — US disclosed
EP-0304842-A2 Isoprenoid derivatives and anti-ulcer agents containing the same NISSHIN FLOUR MILLING CO., LTD. (JP) 1989-03-01 — — EP disclosed
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