SCHEMBL11700772

SCHEMBL11700772

CCCCCCCCC(Oc1ccc(C23CC4CC(CC(C4)C2)C3)cc1)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTRC Q99895 1/20 0.48
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
RAB9A P51151 1/20 0.46
PPARA Q07869 7/20 0.43
PPARG P37231 7/20 0.43
PPARD Q03181 2/20 0.43
ALDH2 P05091 1/20 0.42
CASP2 P42575 1/20 0.41
PTGES O14684 1/20 0.41
ALOX5 P09917 1/20 0.41
NPC1 O15118 1/20 0.40
LMNA P02545 2/20 0.40
HIF1A Q16665 2/20 0.40
EPAS1 Q99814 2/20 0.40
ALDH1A1 P00352 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
GAA P10253 1/20 0.39
NCOA3 Q9Y6Q9 1/20 0.39
FAAH O00519 1/20 0.38

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
SCHEMBL11703273 0.89 MEN1 (0.44) CTRCMEN1KMT2ARAB9APPARA
SCHEMBL31144647 0.82 CTRC (0.63) CTRCPPARAPPARGALDH2PTGES
SCHEMBL11854295 0.77 CTRC (0.58) CTRCPPARAPPARGALDH2PTGES
SCHEMBL11576734 0.77 CTRC (0.58) CTRCPPARAPPARGALDH2PTGES
SCHEMBL6342298 0.77 CTRC (0.64) CTRCPPARAPPARGALDH2PTGES
SCHEMBL570688 0.77 CTRC (0.64) CTRCPPARAPPARGALDH2PTGES
SCHEMBL15903011 0.77 CTRC (0.64) CTRCPPARAPPARGALDH2PTGES
SCHEMBL4001414 0.77 CTRC (0.64) CTRCPPARAPPARGALDH2PTGES
SCHEMBL4002165 0.77 CTRC (0.64) CTRCPPARAPPARGALDH2PTGES
SCHEMBL22828775 0.77 CTRC (0.64) CTRCPPARAPPARGALDH2PTGES

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-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