SCHEMBL320022

SCHEMBL320022

CCCCCC[C@@H](O)C/C=C\CCCCCCC(C(=O)O)C(=O)O

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.76
FFAR4 Q5NUL3 1/20 0.76
FAAH O00519 3/20 0.66
NFKB1 P19838 1/20 0.59
NFKB2 Q00653 1/20 0.59
RELA Q04206 1/20 0.59
GPR84 Q9NQS5 4/20 0.49
TERT O14746 3/20 0.49
PTPN1 P18031 3/20 0.49
PPARG P37231 3/20 0.49
PPARD Q03181 3/20 0.49
PPARA Q07869 3/20 0.49
MAPT P10636 2/20 0.49
BLM P54132 2/20 0.49
HSD17B10 Q99714 2/20 0.49
FABP4 P15090 2/20 0.49
GMNN O75496 1/20 0.49
USP2 O75604 1/20 0.49
LMNA P02545 1/20 0.49
CYP1A2 P05177 1/20 0.49

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
SCHEMBL3781862 0.93 FFAR1 (0.70) FFAR1FFAR4FAAHNFKB1NFKB2
SCHEMBL1970506 0.91 FFAR1 (0.68) FFAR1FFAR4FAAHNFKB1NFKB2
SCHEMBL27815201 0.90 FFAR1 (0.61) FFAR1FFAR4FAAHGPR84TERT
SCHEMBL3372226 0.90 FFAR1 (0.75) FFAR1FFAR4FAAHNFKB1NFKB2
SCHEMBL27496579 0.89 FFAR1 (0.74) FFAR1FFAR4FAAHNFKB1NFKB2
SCHEMBL28478042 0.89 FFAR1 (0.74) FFAR1FFAR4FAAHNFKB1NFKB2
SCHEMBL321065 0.89 FFAR1 (0.74) FFAR1FFAR4FAAHNFKB1NFKB2
SCHEMBL30448281 0.89 FFAR1 (0.74) FFAR1FFAR4FAAHNFKB1NFKB2
SCHEMBL11224779 0.89 FFAR1 (0.65) FFAR1FFAR4FAAHNFKB1NFKB2
SCHEMBL23092270 0.88 FFAR1 (0.76) FFAR1FFAR4FAAHNFKB1NFKB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2545093-A2 POLYURETHANE POLYMERS COMPRISING COPOLYESTER POLYOLS HAVING REPEAT UNITS DERIVED FROM BIOBASED -HYDROXYFATTY ACIDS Synthezyme LLC (US) 2013-01-16 EP claimed
EP-2536776-A2 COPOLYESTERS HAVING REPEAT UNITS DERIVED FROM -HYDROXY FATTY ACIDS Synthezyme LLC (US) 2012-12-26 EP claimed
WO-2011112923-A9 POLYURETHANE POLYMERS COMPRISING COPOLYESTER POLYOLS HAVING REPEAT UNITS DERIVED FROM BIOBASED ω-HYDROXYFATTY ACIDS SYNTHEZYME LLC (US) 2012-01-12 WO claimed
WO-2011112923-A2 POLYURETHANE POLYMERS COMPRISING COPOLYESTER POLYOLS HAVING REPEAT UNITS DERIVED FROM BIOBASED ω-HYDROXYFATTY ACIDS SYNTHEZYME LLC (US) 2011-09-15 WO claimed
WO-2011103193-A2 COPOLYESTERS HAVING REPEAT UNITS DERIVED FROM ω-HYDROXY FATTY ACIDS SYNTHEZYME LLC (US) 2011-08-25 WO claimed
EP-2545093-A2 POLYURETHANE POLYMERS COMPRISING COPOLYESTER POLYOLS HAVING REPEAT UNITS DERIVED FROM BIOBASED -HYDROXYFATTY ACIDS Synthezyme LLC (US) 2013-01-16 EP disclosed
WO-2011112923-A9 POLYURETHANE POLYMERS COMPRISING COPOLYESTER POLYOLS HAVING REPEAT UNITS DERIVED FROM BIOBASED ω-HYDROXYFATTY ACIDS SYNTHEZYME LLC (US) 2012-01-12 WO disclosed
WO-2011112923-A2 POLYURETHANE POLYMERS COMPRISING COPOLYESTER POLYOLS HAVING REPEAT UNITS DERIVED FROM BIOBASED ω-HYDROXYFATTY ACIDS SYNTHEZYME LLC (US) 2011-09-15 WO disclosed
WO-2010022200-A1 METHOD FOR PREPARING LONG-CHAIN HYDROXYACIDS, DIACIDS AND OLIGOMERS AND POLYLMERS THEREOF POLYTECHNIC INSTITUTE OF NEW YORK UNIVERSITY (US) 2010-02-25 WO disclosed