SCHEMBL2560615

SCHEMBL2560615

COc1cccc(OCc2cccc(B(O)O)c2)c1

nearest known ligand 0.66

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 10/20 0.66
▸ ENPP2 Q13822 3/20 0.65
▸ MRGPRX4 Q96LA9 2/20 0.59
▸ APP P05067 1/20 0.55
▸ TP53 P04637 1/20 0.50
▸ PKM P14618 1/20 0.50
▸ NFKB1 P19838 1/20 0.50
▸ RAB9A P51151 1/20 0.50
▸ NFKB2 Q00653 1/20 0.50
▸ RELA Q04206 1/20 0.50
▸ SMN1; SMN2 Q16637 1/20 0.50
▸ RXFP1 Q9HBX9 1/20 0.50
▸ IDO1 P14902 1/20 0.49
▸ AGXT P21549 1/20 0.49

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
SCHEMBL22874 0.94 ENPP2 (0.70) MAOBENPP2MRGPRX4APPTP53
SCHEMBL15331009 0.91 ENPP2 (0.74) MAOBENPP2MRGPRX4TP53PKM
SCHEMBL23719 0.88 ENPP2 (0.65) MAOBENPP2MRGPRX4APPRAB9A
SCHEMBL22563 0.86 ENPP2 (0.67) MAOBENPP2APPRAB9A
SCHEMBL15332207 0.86 MAOB (0.67) MAOBENPP2MRGPRX4APPRAB9A
SCHEMBL2555516 0.85 ENPP2 (0.59) MAOBENPP2MRGPRX4SMN1; SMN2
SCHEMBL16687432 0.85 ENPP2 (0.59) MAOBENPP2
SCHEMBL29138052 0.84 ENPP2 (0.65) MAOBENPP2MRGPRX4TP53PKM
SCHEMBL30688670 0.84 ENPP2 (0.65) MAOBENPP2MRGPRX4TP53PKM
SCHEMBL15330536 0.82 NR4A2 (0.56) MAOBENPP2PKMRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 — — US disclosed
US-11225655-B2 Bi-functional complexes and methods for making and using such complexes NUEVOLUTION A/S (DK) 2022-01-18 — — US disclosed
EP-3540059-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES Nuevolution A/S (DK) 2019-09-18 — — EP disclosed
EP-2558577-B1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION AS (DK) 2018-12-12 — — EP disclosed
US-20130281324-A1 BI-FUNCTINAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2013-10-24 — — US disclosed
EP-2558577-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES Nuevolution A/S (DK) 2013-02-20 — — EP disclosed
WO-2011127933-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2011-10-20 — — WO disclosed
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