SCHEMBL2526270

SCHEMBL2526270

NCOc1ccc(Cc2ccc(OCCCC(=O)O)cc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ LTA4H P09960 10/20 0.57
▸ FFAR1 O14842 3/20 0.53
▸ LMNA P02545 1/20 0.50
▸ L3MBTL1 Q9Y468 1/20 0.50
▸ PPARA Q07869 2/20 0.49
▸ PPARG P37231 1/20 0.48

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
SCHEMBL12117110 0.83 L3MBTL1 (0.67) LTA4HFFAR1LMNAL3MBTL1
SCHEMBL31448501 0.82 PPARA (0.65) FFAR1LMNAL3MBTL1PPARA
SCHEMBL20799670 0.81 FFAR1 (0.65) FFAR1LMNAL3MBTL1PPARG
SCHEMBL2891962 0.80 FFAR1 (0.58) LTA4HFFAR1LMNAL3MBTL1PPARA
SCHEMBL10728695 0.80 PLA2G4B (0.59) LTA4HFFAR1LMNAL3MBTL1PPARA
SCHEMBL10207287 0.78 LMNA (0.63) FFAR1LMNAL3MBTL1PPARA
SCHEMBL12099337 0.78 PPARA (0.56) FFAR1LMNAL3MBTL1PPARA
SCHEMBL31448470 0.77 PPARA (0.73) FFAR1LMNAL3MBTL1PPARA
SCHEMBL928209 0.76 L3MBTL1 (0.62) LTA4HFFAR1LMNAL3MBTL1PPARA
SCHEMBL29089242 0.75 PLA2G4B (0.68) LMNAL3MBTL1PPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8034900-B2 Water-soluble thioester and selenoester compounds and methods for making and using the same AMYLIN PHARMACEUTICALS, INC. (US) 2011-10-11 — — US disclosed
EP-1631597-A4 DISPLACEABLE LINKER SOLID PHASE CHEMICAL LIGATION GRYPHON THERAPEUTICS INC (US) 2007-07-11 — — EP disclosed
US-20060275768-A1 Multiplex polymer ligation AMYLIN PHARMACEUTICALS, INC. 2006-12-07 — — US disclosed
EP-1616021-A4 MULTIPLEX POLYMER LIGATION GRYPHON THERAPEUTICS INC (US) 2006-08-30 — — EP disclosed
US-20060173159-A1 Water-soluble thioester and selenoester compounds and methods for making and using the same ASTRAZENECA PHARMACEUTICALS LP 2006-08-03 — — US disclosed
EP-1631597-A2 DISPLACEABLE LINKER SOLID PHASE CHEMICAL LIGATION Gryphon Therapeutics, Inc. (US) 2006-03-08 — — EP disclosed
EP-1616021-A2 MULTIPLEX POLYMER LIGATION Gryphon Therapeutics, Inc. (US) 2006-01-18 — — EP disclosed
WO-2004105685-A2 DISPLACEABLE LINKER SOLID PHASE CHEMICAL LIGATION GRYPHON THERAPEUTICS, INC. (US) 2004-12-09 — — WO disclosed
WO-2004060925-A2 MULTIPLEX POLYMER LIGATION GRYPHON THERAPEUTICS, INC. (US) 2004-07-22 — — WO disclosed
WO-2004060863-A2 BACKBONE ANCHORED THIOESTER AND SELENOESTER GENERATORS GRYPHON THERAPEUTICS, INC. (US) 2004-07-22 — — WO disclosed
US-20040132966-A1 Backbone anchored thioester and selenoester generators GRYPHON THERAPEUTICS, INC. 2004-07-08 — — US disclosed
US-20040063902-A1 Side chain anchored thioester and selenoester generators GRYPHON THERAPEUTICS, INC. 2004-04-01 — — US disclosed
WO-2004011424-A2 SIDE CHAIN ANCHORED THIOESTER AND SELENOESTER GENERATORS GRYPHON THERAPEUTICS, INC. (US) 2004-02-05 — — WO disclosed
US-6566494-B1 Solid support for use in the generation of preferential peptides REGENTS OF THE UNIVERSITY OF MINNESOTA 2003-05-20 — — US disclosed
US-5917015-A Support material for solid phase organic synthesis REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 1999-06-29 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040132966-A1 Backbone anchored thioester and selenoester generators SCLY, SELENOI, ETF1 LTA4H 2674/4885FFAR1 2845/4885LMNA 4373/4885
US-20060173159-A1 Water-soluble thioester and selenoester compounds and methods for making and using the same SCLY, TST, SELENOI LTA4H 2148/4885FFAR1 3591/4885LMNA 3396/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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