SCHEMBL7139686

SCHEMBL7139686

C=CC(=O)OC(C)(c1ccccc1)c1ccccc1.Oc1ccc(C=CC=Cc2ccccc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APP P05067 1/20 0.41
CA12 O43570 5/20 0.41
CA7 P43166 5/20 0.41
CA9 Q16790 5/20 0.41
CA14 Q9ULX7 5/20 0.41
AKR1B10 O60218 5/20 0.41
AKR1B1 P15121 5/20 0.41
CA4 P22748 2/20 0.41
CA6 P23280 2/20 0.41
CA5A P35218 2/20 0.41
CA5B Q9Y2D0 2/20 0.41
CA1 P00915 4/20 0.40
CA2 P00918 4/20 0.40
TYR P14679 2/20 0.40
ABCG2 Q9UNQ0 1/20 0.40
STAT3 P40763 1/20 0.39
CYP3A4 P08684 3/20 0.39
MAOB P27338 3/20 0.39
HSPD1 P10809 2/20 0.39
HSPE1 P61604 2/20 0.39

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
SCHEMBL1506719 0.89 APP (0.43) APPCA12CA7CA9CA14
SCHEMBL5439459 0.88 APP (0.42) APPCA12CA7CA9CA14
SCHEMBL7106755 0.87 CA12 (0.42) APPCA12CA7CA9CA14
SCHEMBL5448012 0.85 TRPV1 (0.41) APPCA12CA7CA9CA14
SCHEMBL5440639 0.84 MAPT (0.41) APPCA12CA7CA9CA14
SCHEMBL3169549 0.83 CYP2C19 (0.46) CYP3A4KMT2AMAPTCYP2C19ALDH1A1
SCHEMBL7732137 0.83 AKR1B10 (0.43) APPCA12CA7CA9CA14
Acrylic Acid Methyl Ester SCHEMBL2707868 0.82 CA12 (0.57) APPCA12CA7CA9CA14
SCHEMBL6845429 0.81 CCNB2 (0.47) APPCA12CA7CA9CA14
SCHEMBL5452249 0.80 CYP1A2 (0.45) APPCA12CA7CA9CA14

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-20030017425-A1 Pattern formation method MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) 2003-01-23 US disclosed