SCHEMBL4373690

SCHEMBL4373690

C=CCC(=CC)CCC=CCC

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.39
CYP19A1 P11511 4/20 0.39
MAPT P10636 4/20 0.39
PPARG P37231 3/20 0.39
OXER1 Q8TDS5 3/20 0.39
RXRA P19793 2/20 0.39
FFAR1 O14842 2/20 0.39
F7 P08709 3/20 0.33
F3 P13726 3/20 0.33
PTGS1 P23219 2/20 0.33
KMT2A Q03164 2/20 0.33
PPARD Q03181 2/20 0.33
PPARA Q07869 2/20 0.33
ADORA3 P0DMS8 2/20 0.33
FAAH O00519 1/20 0.33
CNR1 P21554 1/20 0.33
NR1I2 O75469 2/20 0.32
PTGS2 P35354 2/20 0.32
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32

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
SCHEMBL4373688 1.00 ALDH1A1 (0.39) ALDH1A1CYP19A1MAPTPPARGOXER1
SCHEMBL400668 0.88 TSHR (0.39) ALDH1A1
SCHEMBL400669 0.88 TSHR (0.39) ALDH1A1
SCHEMBL51536 0.85 FNTA (0.32)
SCHEMBL51535 0.85 FNTA (0.32)
SCHEMBL15825638 0.77 TSHR (0.32) ALDH1A1
SCHEMBL15825639 0.77 TSHR (0.32) ALDH1A1
SCHEMBL690444 0.75
SCHEMBL3644029 0.75
SCHEMBL849066 0.74 TSHR (0.42) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1626851-B1 PROCESS FOR PREPARING UV CURABLE SEALING ASSEMBLIES DUPONT DOW ELASTOMERS LLC (US) 2009-09-30 EP disclosed