SCHEMBL2554884

SCHEMBL2554884

Cc1ccc(OCc2ccc(B(O)O)cc2)c(Cl)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 1/20 0.59
MRGPRX4 Q96LA9 6/20 0.53
RAB9A P51151 5/20 0.45
NPC1 O15118 4/20 0.45
HPGD P15428 3/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
PPARG P37231 1/20 0.44
RXRA P19793 1/20 0.44
RXRB P28702 1/20 0.44
RXRG P48443 1/20 0.44
MAPT P10636 3/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
ATM Q13315 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
CA2 P00918 1/20 0.43
LPL P06858 1/20 0.43
LIPG Q9Y5X9 1/20 0.43
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
CYP1A2 P05177 1/20 0.42

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
SCHEMBL2560524 0.91 ENPP2 (0.52) ENPP2MRGPRX4RAB9ANPC1HPGD
SCHEMBL13929749 0.86 MRGPRX4 (0.58) MRGPRX4RAB9ANPC1HPGDSMN1; SMN2
SCHEMBL2561404 0.85 MRGPRX4 (0.51) ENPP2MRGPRX4RAB9ANPC1SMN1; SMN2
SCHEMBL2558867 0.85 MRGPRX4 (0.62) ENPP2MRGPRX4RAB9ANPC1HPGD
SCHEMBL2558238 0.85 ALDH1A1 (0.48) ENPP2RAB9ANPC1HPGDSMN1; SMN2
SCHEMBL2558808 0.85 MRGPRX4 (0.63) ENPP2MRGPRX4RAB9ANPC1SMN1; SMN2
SCHEMBL2560162 0.82 ENPP2 (0.56) ENPP2MRGPRX4RAB9ANPC1HPGD
SCHEMBL16210297 0.82 MRGPRX4 (0.53) ENPP2MRGPRX4RAB9ANPC1MAPT
SCHEMBL12261269 0.82 ENPP2 (0.62) ENPP2MRGPRX4RAB9ANPC1SMN1; SMN2
SCHEMBL13929748 0.81 MRGPRX4 (0.55) MRGPRX4RAB9ANPC1HPGDSMN1; SMN2

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