SCHEMBL8210346

SCHEMBL8210346

C=CCC=CCCC=CCC=CC

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.35
MAPT P10636 2/20 0.35
PTGS1 P23219 2/20 0.35
F13A1 P00488 1/20 0.35
THRB P10828 1/20 0.35
FASN P49327 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
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
F7 P08709 1/20 0.30
ADORA3 P0DMS8 1/20 0.30
F3 P13726 1/20 0.30
KMT2A Q03164 1/20 0.30
PPARD Q03181 1/20 0.30
PPARA Q07869 1/20 0.30

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
SCHEMBL5209824 0.92 TSHR (0.30)
SCHEMBL5209819 0.92 TSHR (0.30)
SCHEMBL1113532 0.92
SCHEMBL723488 0.90 ALDH1A1 (0.35) ALDH1A1MAPTPTGS1F13A1THRB
SCHEMBL723487 0.90 ALDH1A1 (0.35) ALDH1A1MAPTPTGS1F13A1THRB
SCHEMBL22509 0.86
SCHEMBL1760721 0.86
SCHEMBL22508 0.86
SCHEMBL22206083 0.85 TRPV1 (0.34) ALDH1A1MAPTPTGS1CYP19A1RXRA
SCHEMBL5852573 0.83 TSHR (0.38) ALDH1A1

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
EP-1007587-A1 RHEOLOGY MODIFICATION OF ELASTOMERS THE DOW CHEMICAL COMPANY (US) 2000-06-14 EP disclosed
WO-1999010423-A1 RHEOLOGY MODIFICATION OF ELASTOMERS THE DOW CHEMICAL COMPANY (US) 1999-03-04 WO disclosed