SCHEMBL19070823

SCHEMBL19070823

CCc1ccc(O)cc1C1=C(O)CC(CC2CCOC2)C1=O

nearest known ligand 0.32

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ HSD17B3 P37058 1/20 0.32
▸ CNR1 P21554 2/20 0.31
▸ CNR2 P34972 2/20 0.31
▸ DRD4 P21917 1/20 0.31
▸ PIK3CA P42336 2/20 0.31
▸ CYP26A1 O43174 1/20 0.30
▸ PIK3CD O00329 1/20 0.30
▸ PIK3CB P42338 1/20 0.30
▸ PIK3CG P48736 1/20 0.30
▸ ANPEP P15144 1/20 0.30
▸ DPP4 P27487 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
SCHEMBL19070272 0.93 CNR1 (0.34) HSD17B3CNR1CNR2CYP26A1ANPEP
SCHEMBL19071149 0.88 DRD4 (0.33) CNR1CNR2DRD4PIK3CACYP26A1
SCHEMBL16256580 0.88 CYP24A1 (0.36) CNR1CNR2PIK3CACYP26A1PIK3CG
SCHEMBL19071000 0.85 DRD4 (0.33) CNR1CNR2DRD4PIK3CAPIK3CD
SCHEMBL19070718 0.81 RIPK2 (0.36) CNR1CNR2CYP26A1
SCHEMBL16256586 0.81 CYP24A1 (0.37) CNR1CNR2CYP26A1PIK3CG
SCHEMBL19070317 0.78 OPRL1 (0.33) CNR1CNR2PIK3CACYP26A1PIK3CD
SCHEMBL16256582 0.76 CYP26A1 (0.36) CNR1CNR2PIK3CACYP26A1
SCHEMBL19071419 0.76 MEN1 (0.34) HSD17B3CYP26A1ANPEPDPP4
SCHEMBL19071509 0.75 XDH (0.33) DRD4PIK3CAPIK3CDPIK3CBPIK3CG

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-2389066-B1 CYCLOPENTADIONE DERIVED HERBICIDES SYNGENTA LTD (GB) 2017-07-05 — — EP disclosed
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