SCHEMBL11706453

SCHEMBL11706453

O=C(O)CCCCOc1ccc(C23CC4CC(CC(C4)C2)C3)cc1

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.60
KMT2A Q03164 2/20 0.60
RAB9A P51151 1/20 0.60
LMNA P02545 2/20 0.59
ALDH1A1 P00352 1/20 0.59
L3MBTL1 Q9Y468 1/20 0.59
HIF1A Q16665 8/20 0.53
EPAS1 Q99814 4/20 0.53
PPARA Q07869 3/20 0.50
CASP2 P42575 1/20 0.49
EPHX2 P34913 1/20 0.47
ESR1 P03372 1/20 0.46
MDH1 P40925 1/20 0.46
MDH2 P40926 1/20 0.46
EP300 Q09472 1/20 0.46
ALB P02768 1/20 0.45

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
SCHEMBL11702997 0.99 MEN1 (0.59) MEN1KMT2ARAB9ALMNAALDH1A1
SCHEMBL417133 0.96 MEN1 (0.62) MEN1KMT2ARAB9ALMNAALDH1A1
Hydrochloric Acid SCHEMBL11702177 0.94 MEN1 (0.63) MEN1KMT2ARAB9ALMNAALDH1A1
SCHEMBL419725 0.92 MEN1 (0.63) MEN1KMT2ARAB9ALMNAALDH1A1
SCHEMBL11702166 0.84 MEN1 (0.62) MEN1KMT2ARAB9ALMNAALDH1A1
SCHEMBL11701921 0.84 MEN1 (0.74) MEN1KMT2ARAB9ALMNAALDH1A1
SCHEMBL421046 0.82 MEN1 (0.76) MEN1KMT2ARAB9ALMNAALDH1A1
SCHEMBL1083023 0.82 MEN1 (0.76) MEN1KMT2ARAB9ALMNAALDH1A1
SCHEMBL11704369 0.82 MEN1 (0.66) MEN1KMT2ARAB9ALMNAALDH1A1
SCHEMBL11702514 0.82 MEN1 (0.53) MEN1KMT2ARAB9ALMNAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-3933835-A ANTIALLERGENS, HYPOLIPIDAEMIC CIBA-GEIGY CORPORATION (US) 1976-01-20 US claimed
US-4035413-A ANTIALLERGENS, ANTILIPAEMIC AGENTS CIBA-GEIGY CORPORATION (US) 1977-07-12 US disclosed
US-4013719-A ANTILIPEMIC, ANTIALLERGEN CIBA-GEIGY CORPORATION (US) 1977-03-22 US disclosed
US-4000183-A ANTIALLERGENS AND HYPOLIPIDAEMIC AGENTS CIBA-GEIGY CORPORATION (US) 1976-12-28 US disclosed
US-4000144-A HYPOLIPIDAEMIC AGENTS AND ANTIALLERGENS CIBA-GEIGY CORPORATION (US) 1976-12-28 US disclosed
US-3933835-A ANTIALLERGENS, HYPOLIPIDAEMIC CIBA-GEIGY CORPORATION (US) 1976-01-20 US disclosed