SCHEMBL11488102

SCHEMBL11488102

O=C1c2ccccc2C2(OCCCCO2)c2ccccc21

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
POLB P06746 2/20 0.54
GAA P10253 1/20 0.50
MAPK1 P28482 1/20 0.50
CDC25B P30305 1/20 0.41
ALDH1A1 P00352 3/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
USP8 P40818 1/20 0.39
TSHR P16473 4/20 0.39
KCNQ2 O43526 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
ALOX15 P16050 1/20 0.39
PKM P14618 1/20 0.38
LMNA P02545 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MAOA P21397 1/20 0.38
HTT P42858 1/20 0.38

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
SCHEMBL11481755 0.92 ALDH1A1 (0.46) MEN1KMT2APOLBGAAMAPK1
SCHEMBL29869432 0.79 USP8 (0.49) MEN1KMT2APOLBGAAMAPK1
SCHEMBL16532992 0.79 USP8 (0.49) MEN1KMT2APOLBGAAMAPK1
SCHEMBL23542056 0.77 MEN1 (0.50) MEN1KMT2APOLBMAPK1CDC25B
SCHEMBL18288037 0.75 MEN1 (0.41) MEN1KMT2APOLBGAAMAPK1
SCHEMBL18287971 0.72 MAPK1 (0.41) MEN1KMT2APOLBGAAMAPK1
SCHEMBL11481917 0.70 LMNA (0.40) MEN1KMT2APOLBCDC25BALDH1A1
Anthraquinone SCHEMBL28163102 0.70 MEN1 (0.60) MEN1KMT2APOLBMAPK1CDC25B
SCHEMBL8815294 0.69 MEN1 (0.50) MEN1KMT2APOLBMAPK1CDC25B
SCHEMBL357510 0.68 MEN1 (0.55) MEN1KMT2APOLBMAPK1CDC25B

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
US-4188224-A (METH)ACRYLIC ESTERS AND AN ANTHRONE PHOTOINITIATOR CIBA-GEIGY CORPORATION (US) 1980-02-12 US disclosed