SCHEMBL23956366

SCHEMBL23956366

Cc1cccc(-c2ccc(B3OC(C)(C)C(C)(C)O3)cc2)c1

nearest known ligand 0.69

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 14/20 0.69
LPL P06858 13/20 0.69
PGR P06401 1/20 0.43
ENPP3 O14638 1/20 0.43
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.40
CA9 Q16790 2/20 0.40
CA12 O43570 1/20 0.40
CA3 P07451 1/20 0.40
CA4 P22748 1/20 0.40
CA6 P23280 1/20 0.40
CA5A P35218 1/20 0.40
CA7 P43166 1/20 0.40
CA14 Q9ULX7 1/20 0.40
CA5B Q9Y2D0 1/20 0.40

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
SCHEMBL24326281 0.91 LIPG (0.58) LIPGLPLPGRENPP3CA1
SCHEMBL25626105 0.88 LIPG (0.51) LIPGLPLPGRENPP3
SCHEMBL24767667 0.88 LIPG (0.61) LIPGLPLPGRENPP3
SCHEMBL28389622 0.88 LIPG (0.88) LIPGLPLCA1CA2CA9
SCHEMBL12715045 0.87 LIPG (0.50) LIPGLPLPGRENPP3
SCHEMBL20026486 0.87 LIPG (0.50) LIPGLPLPGRENPP3
SCHEMBL17539929 0.86 LIPG (0.86) LIPGLPLCA1CA2CA9
SCHEMBL19107132 0.86 LIPG (0.86) LIPGLPLCA1CA2CA9
SCHEMBL15458626 0.86 LIPG (0.86) LIPGLPLCA1CA2CA9
SCHEMBL20094842 0.86 LIPG (0.58) LIPGLPLPGRENPP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022255428-A1 AROMATIC COMPOUND, ORGANIC ELECTROLUMINESCENT ELEMENT, COMPOSITION, AND METHOD FOR PRODUCING ORGANIC ELECTROLUMINESCENT ELEMENT 三菱ケミカル株式会社 2022-12-08 WO disclosed
EP-3601304-B1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2021-10-27 EP disclosed