Propene

Propene

SCHEMBL7102860

C=CC.CCC=COC(C)=O

nearest known ligand 0.32

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.32
CYP19A1 P11511 2/20 0.32
RXRA P19793 2/20 0.32
PPARG P37231 2/20 0.32
OXER1 Q8TDS5 2/20 0.32
FFAR1 O14842 1/20 0.32
MAPT P10636 1/20 0.32
LMNA P02545 1/20 0.32
HSD17B10 Q99714 1/20 0.32
TSHR P16473 1/20 0.31
PTGS1 P23219 2/20 0.31
ADORA3 P0DMS8 2/20 0.31
NR1I2 O75469 1/20 0.31
PGR P06401 1/20 0.31
PTGS2 P35354 1/20 0.31
PDE4D Q08499 1/20 0.31
F7 P08709 1/20 0.31
F3 P13726 1/20 0.31
KMT2A Q03164 1/20 0.31
PPARD Q03181 1/20 0.31

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
SCHEMBL30038 0.91
SCHEMBL2375960 0.91
Fluoride SCHEMBL134341 0.89
SCHEMBL8464406 0.78 PTGS1 (0.46) ALDH1A1CYP19A1RXRAPPARGOXER1
SCHEMBL30486744 0.78 ALDH1A1 (0.46) ALDH1A1CYP19A1RXRAPPARGOXER1
SCHEMBL28191437 0.77 ALDH1A1 (0.35) ALDH1A1CYP19A1RXRAPPARGOXER1
SCHEMBL5287805 0.77 TRPA1 (0.40) ALDH1A1CYP19A1RXRAPPARGOXER1
SCHEMBL10856443 0.77 TRPA1 (0.40) ALDH1A1CYP19A1RXRAPPARGOXER1
SCHEMBL5287799 0.77 TRPA1 (0.40) ALDH1A1CYP19A1RXRAPPARGOXER1
SCHEMBL27289509 0.77 ALDH1A1 (0.31) ALDH1A1CYP19A1RXRAPPARGOXER1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6555605-B1 Conductor and a sheath of a halogen-free polymer, magnesium hydroxide, calcium carbonate and a phosphorus and nitrogen compound PIRELLI CAVI E SISTEMI S.P.A. (IT) 2003-04-29 US claimed
EP-0831120-A1 Flame-retardant composition for polymer compounds PIRELLI CAVI E SISTEMI S.p.A. (IT) 1998-03-25 EP claimed