SCHEMBL8768505

SCHEMBL8768505

COC(=O)COc1cc(O)ccc1NC(=O)C(C)c1cccc(OCCCCOc2ccccc2)c1.O=C(O)CCc1ccc(OCCCCOc2ccccc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ FFAR1 O14842 10/20 0.44
▸ MEN1 O00255 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ L3MBTL1 Q9Y468 3/20 0.41
▸ PPARG P37231 1/20 0.40
▸ PPARD Q03181 1/20 0.40
▸ PPARA Q07869 1/20 0.40
▸ FFAR4 Q5NUL3 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ PLA2G4B P0C869 1/20 0.39
▸ GLI1 P08151 1/20 0.39
▸ GLI2 P10070 1/20 0.39

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
SCHEMBL8422412 0.92 MEN1 (0.48) MEN1KMT2AL3MBTL1POLBLMNA
SCHEMBL8768516 0.85 FFAR1 (0.52) FFAR1MEN1KMT2APPARGPPARD
SCHEMBL8420268 0.81 MEN1 (0.46) MEN1KMT2AL3MBTL1POLBLMNA
SCHEMBL8422415 0.80 HPGD (0.48) FFAR1MEN1KMT2APOLB
SCHEMBL8420641 0.78 L3MBTL1 (0.47) FFAR1MEN1KMT2AL3MBTL1PPARG
SCHEMBL8422536 0.77 HTT (0.46) L3MBTL1POLBLMNA
SCHEMBL8422462 0.76 L3MBTL1 (0.45) L3MBTL1PPARAPOLBLMNA
SCHEMBL8767356 0.76 LNPEP (0.41) FFAR1PLA2G4B
SCHEMBL8422409 0.73 PPARD (0.53) MEN1KMT2AL3MBTL1PPARDPOLB
SCHEMBL8422576 0.72 AKR1C2 (0.48) KMT2AL3MBTL1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0791576-A2 Leukotriene antagonistic benzoic acid derivatives BAYER AG (DE) 1997-08-27 — — EP disclosed
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