Furan

Furan

SCHEMBL28287331

O=C(O)COC1CCCCC1.c1ccoc1

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 6/20 0.39
THRA P10827 2/20 0.38
THRB P10828 2/20 0.38
ITGB3 P05106 2/20 0.36
ITGA2B P08514 2/20 0.36
PTGIR P43119 4/20 0.36
PTGDR Q13258 3/20 0.33
ALDH1A1 P00352 1/20 0.33
PTGER2 P43116 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL15159536 0.85 THRA (0.42) PTGDR2THRATHRBITGB3ITGA2B
SCHEMBL16204628 0.85 THRA (0.42) PTGDR2THRATHRBITGB3ITGA2B
SCHEMBL1734827 0.85 THRA (0.42) PTGDR2THRATHRBITGB3ITGA2B
SCHEMBL27451178 0.85 THRA (0.42) PTGDR2THRATHRBITGB3ITGA2B
SCHEMBL9132526 0.85 THRA (0.42) PTGDR2THRATHRBITGB3ITGA2B
SCHEMBL24564741 0.85 THRA (0.42) PTGDR2THRATHRBITGB3ITGA2B
SCHEMBL360541 0.83 ITGB3 (0.41) PTGDR2THRATHRBITGB3ITGA2B
SCHEMBL1733927 0.79
SCHEMBL9194978 0.74
SCHEMBL461965 0.73 ITGB3 (0.38) PTGDR2THRATHRBITGB3ITGA2B

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
CN-109568166-A Fragrance material 宝洁公司 2019-04-05 CN disclosed