SCHEMBL8387014

SCHEMBL8387014

O=C(O)Cc1cccc2c1ccn2Cc1cccc(OCc2ccccc2)c1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MPO P05164 1/20 0.55
▸ PPARD Q03181 4/20 0.55
▸ PPARG P37231 3/20 0.55
▸ PPARA Q07869 3/20 0.55
▸ ALDH1A1 P00352 1/20 0.52
▸ LMNA P02545 1/20 0.52
▸ MAPK14 Q16539 1/20 0.48
▸ CFD P00746 1/20 0.47
▸ LTB4R Q15722 1/20 0.46
▸ LTB4R2 Q9NPC1 1/20 0.46
▸ FFAR1 O14842 1/20 0.46
▸ NR4A2 P43354 1/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ FAAH O00519 1/20 0.43
▸ MCL1 Q07820 1/20 0.43
▸ MAOB P27338 1/20 0.43

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
SCHEMBL8172515 0.88 LMNA (0.68) PPARDPPARGPPARAALDH1A1LMNA
SCHEMBL8388314 0.84 ALDH1A1 (0.61) MPOALDH1A1LMNAL3MBTL1
SCHEMBL13930965 0.82 PPARD (0.77) PPARDPPARGPPARAALDH1A1LMNA
SCHEMBL3919503 0.82 THRA (0.48) MPOPPARDPPARGPPARAALDH1A1
SCHEMBL8387016 0.81 MPO (0.47) MPOPPARDPPARGPPARAMAPK14
SCHEMBL8388829 0.80 ALDH1A1 (0.48) MPOALDH1A1LMNAFAAH
SCHEMBL5639523 0.80 PPARD (0.60) PPARDPPARGPPARAALDH1A1LMNA
SCHEMBL8175259 0.79 PPARD (0.66) PPARDPPARGPPARAALDH1A1LMNA
SCHEMBL8174606 0.79 PPARD (0.72) PPARDPPARGPPARAALDH1A1LMNA
SCHEMBL8171659 0.78 PPARD (0.82) PPARDPPARGPPARAALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5877199-A ALZHEIMER'S DISEASE; SEDATIVE SANKYO COMPANY, LIMITED (JP) 1999-03-02 — — US disclosed
EP-0804416-A1 HETEROCYCLIC COMPOUNDS, USEFUL AS ALLOSTERIC EFFECTORS AT MUSCARINIC RECEPTORS SANKYO COMPANY LIMITED (JP) 1997-11-05 — — EP disclosed
WO-1996003377-A1 HETEROCYCLIC COMPOUNDS, USEFUL AS ALLOSTERIC EFFECTORS AT MUSCARINIC RECEPTORS SANKYO COMPANY, LIMITED (JP) 1996-02-08 — — WO disclosed
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