SCHEMBL8978596

SCHEMBL8978596

C=C(C)CCCC=CCC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.50
CYP19A1 P11511 4/20 0.50
PPARG P37231 4/20 0.50
F7 P08709 3/20 0.50
F3 P13726 3/20 0.50
OXER1 Q8TDS5 3/20 0.50
ADORA3 P0DMS8 2/20 0.50
PTGS1 P23219 2/20 0.50
KMT2A Q03164 2/20 0.50
PPARD Q03181 2/20 0.50
PPARA Q07869 2/20 0.50
RXRA P19793 2/20 0.50
NR1I2 O75469 2/20 0.44
PTGS2 P35354 2/20 0.44
PGR P06401 1/20 0.44
PDE4D Q08499 1/20 0.44
MAPT P10636 3/20 0.42
FFAR1 O14842 2/20 0.42
CYP3A4 P08684 2/20 0.42
ALOX15 P16050 2/20 0.42

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
SCHEMBL18737628 0.94 ALDH1A1 (0.60) ALDH1A1CYP19A1PPARGF7F3
SCHEMBL19293251 0.94 ALDH1A1 (0.60) ALDH1A1CYP19A1PPARGF7F3
SCHEMBL9074281 0.86 TOP1 (0.41) ALDH1A1CYP19A1PPARGF7F3
SCHEMBL5014447 0.86 F7 (0.47) ALDH1A1CYP19A1PPARGF7F3
SCHEMBL8852428 0.85
SCHEMBL10880631 0.84 TOP1 (0.53) ALDH1A1CYP19A1PPARGF7F3
SCHEMBL1905045 0.80
SCHEMBL1905047 0.80
SCHEMBL3816950 0.79 F7 (0.55) CYP19A1PPARGF7F3ADORA3
SCHEMBL19293117 0.79 ALDH1A1 (0.57) ALDH1A1CYP19A1PPARGF7F3

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-9212106-B2 Renewable olefins from a mixture of acetic acid and propionic acid WASHINGTON STATE UNIVERSITY (US) 2015-12-15 US disclosed
US-20140128650-A1 RENEWABLE OLEFINS FROM A MIXTURE OF ACETIC ACID AND PROPIONIC ACID ARCHER DANIELS MILDAND COMPANY (US) 2014-05-08 US disclosed
EP-0604210-B1 Frosted plastic container and process for producing the same TOYO SEIKAN KAISHA LTD (JP) 1996-05-08 EP disclosed
US-5436043-A Continuous and disperse phases have spcific dispect ratio and grain size TOYO SEIKAN KAISHA, LTD. (JP) 1995-07-25 US disclosed
EP-0604210-A2 Frosted plastic container and process for producing the same TOYO SEIKAN KAISHA LIMITED (JP) 1994-06-29 EP disclosed