SCHEMBL6928774

SCHEMBL6928774

C/C(=C/O)COc1ccccc1C(=O)c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 7/20 0.49
DRD2 P14416 1/20 0.49
DRD1 P21728 1/20 0.49
DRD3 P35462 1/20 0.49
ELANE P08246 1/20 0.49
PTGDR2 Q9Y5Y4 2/20 0.48
POLB P06746 1/20 0.46
RAB9A P51151 3/20 0.46
NPC1 O15118 1/20 0.46
KDM4E B2RXH2 2/20 0.45
HTT P42858 1/20 0.45
MAPT P10636 2/20 0.44
MAPK1 P28482 1/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
GBA1 P04062 1/20 0.43
TP53 P04637 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43

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
SCHEMBL538221 0.82 ELANE (0.51) ABCB1DRD2DRD1DRD3ELANE
SCHEMBL29388652 0.81 PTGDR2 (0.68) ABCB1DRD2DRD1DRD3ELANE
SCHEMBL867129 0.81 PTGDR2 (0.68) ABCB1DRD2DRD1DRD3ELANE
SCHEMBL22209162 0.78 HTT (0.73) ABCB1DRD2DRD1DRD3ELANE
SCHEMBL720460 0.78 RAB9A (0.67) ABCB1DRD2DRD1DRD3ELANE
SCHEMBL30033997 0.78 RAB9A (0.67) ABCB1DRD2DRD1DRD3ELANE
SCHEMBL21549816 0.78 DRD2 (0.57) ABCB1DRD2DRD1DRD3ELANE
Bicarbonate SCHEMBL27740096 0.76 RAB9A (0.65) ABCB1DRD2DRD1DRD3ELANE
Hydrochloric Acid SCHEMBL8729799 0.76 RAB9A (0.65) ABCB1DRD2DRD1DRD3ELANE
SCHEMBL30149165 0.76 DRD2 (0.57) ABCB1DRD2DRD1DRD3ELANE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1216142-A4 THERMOFORMABLE OPHTHALMIC LENS NOVARTIS AG (CH) 2003-06-11 EP disclosed
EP-1216142-A1 THERMOFORMABLE OPHTHALMIC LENS Wesley Jessen Corporation (US) 2002-06-26 EP disclosed
WO-2001005578-A1 THERMOFORMABLE OPHTHALMIC LENS WESLEY-JESSEN CORPORATION (US) 2001-01-25 WO disclosed