SCHEMBL12087611

SCHEMBL12087611

C=C(/C=C\C)c1ccc(O)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 7/20 0.50
▸ ESR1 P03372 6/20 0.50
▸ KMT2A Q03164 4/20 0.50
▸ HSD17B10 Q99714 3/20 0.50
▸ MEN1 O00255 3/20 0.50
▸ LMNA P02545 3/20 0.50
▸ NR3C1 P04150 2/20 0.50
▸ TP53 P04637 2/20 0.50
▸ CYP1A2 P05177 2/20 0.50
▸ CYP3A4 P08684 2/20 0.50
▸ ADORA3 P0DMS8 2/20 0.50
▸ CYP2D6 P10635 2/20 0.50
▸ CYP2C9 P11712 2/20 0.50
▸ ALOX15 P16050 2/20 0.50
▸ CYP2C19 P33261 2/20 0.50
▸ OPRD1 P41143 2/20 0.50
▸ HIF1A Q16665 2/20 0.50
▸ GAA P10253 1/20 0.50
▸ ALOX12 P18054 1/20 0.50
▸ HTT P42858 2/20 0.48

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
SCHEMBL1071814 0.79 AKT1 (0.38) MAPTKMT2AMEN1LMNACYP3A4
SCHEMBL1071816 0.79 AKT1 (0.38) MAPTKMT2AMEN1LMNACYP3A4
SCHEMBL18637029 0.77 MAPT (0.48) MAPTESR1KMT2AHSD17B10MEN1
SCHEMBL15189004 0.77 CA2 (0.44) MAPTLMNACA12CA1CA2
SCHEMBL17214449 0.76 CYP1A2 (0.41) KMT2AHSD17B10MEN1LMNACYP1A2
SCHEMBL12453517 0.76 F3 (0.59) MAPTESR1KMT2AMEN1LMNA
SCHEMBL14340575 0.76 MAPT (0.46) MAPTESR1KMT2AHSD17B10MEN1
SCHEMBL23786844 0.75 CA1 (0.42) CA1CA2
SCHEMBL8377034 0.75 CYP1A1 (0.45) CYP1A2P4HBPTGS1PTGS2NQO2
Bicarbonate SCHEMBL11378162 0.74 AKT1 (0.43) MAPTKMT2AMEN1LMNACYP3A4

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-2495323-A1 MODIFIED DOUBLE-STRANDED POLYNUCLEOTIDE Daiichi Sankyo Company, Limited (JP) 2012-09-05 — — EP disclosed
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