SCHEMBL2554429

SCHEMBL2554429

Cc1ccccc1OCc1ccc(F)cc1B(O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LIPE Q05469 1/20 0.43
▸ RXRA P19793 1/20 0.41
▸ RXRB P28702 1/20 0.41
▸ RXRG P48443 1/20 0.41
▸ MRGPRX4 Q96LA9 1/20 0.41
▸ RECQL P46063 1/20 0.41
▸ MAPK14 Q16539 1/20 0.40
▸ MAPT P10636 2/20 0.40
▸ ENPP2 Q13822 2/20 0.40
▸ FFAR1 O14842 1/20 0.39
▸ FFAR4 Q5NUL3 1/20 0.39
▸ PPARA Q07869 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ SGMS2 Q8NHU3 1/20 0.38
▸ AOC2 O75106 1/20 0.38
▸ MAOA P21397 1/20 0.38
▸ MAOB P27338 1/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ TSHR P16473 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
SCHEMBL2555799 0.87 ALDH1A1 (0.46) LIPEMRGPRX4MAPK14MAPTENPP2
SCHEMBL2561847 0.84 NPC1 (0.49) LIPERXRARXRBMAPK14MAPT
SCHEMBL2560333 0.83 LIPE (0.53) LIPERXRARXRBRXRGRECQL
SCHEMBL12301131 0.81 MAPK14 (0.55) MAPK14PPARAMAOB
SCHEMBL15331506 0.80 MAPK14 (0.41) LIPERXRARXRBRXRGRECQL
SCHEMBL15331479 0.79 SLC6A2 (0.48) MRGPRX4MAOB
SCHEMBL13154293 0.78 MCL1 (0.45) RXRARXRBRXRGMRGPRX4RECQL
SCHEMBL2559062 0.78 MAOB (0.52) MAOB
SCHEMBL2556663 0.78 MAOB (0.49) FFAR1FFAR4MAOBNPC1RAB9A
SCHEMBL2556251 0.78 LIPE (0.55) LIPEMAPK14ENPP2MAOB

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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