SCHEMBL2563255

SCHEMBL2563255

Cc1ccc(C)c(OCc2ccccc2B(O)O)c1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.46
NPC1 O15118 3/20 0.46
RAB9A P51151 3/20 0.46
MAPT P10636 2/20 0.45
TSHR P16473 1/20 0.44
PTGDR2 Q9Y5Y4 1/20 0.44
LIPE Q05469 1/20 0.44
ALDH1A1 P00352 4/20 0.43
HPGD P15428 1/20 0.43
LMNA P02545 1/20 0.42
HTT P42858 1/20 0.42
CYP2C9 P11712 1/20 0.42
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
ENPP2 Q13822 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
SCHEMBL2554682 0.88 L3MBTL1 (0.47) SMN1; SMN2NPC1RAB9AMAPTTSHR
SCHEMBL8592978 0.85 SMN1; SMN2 (0.54) SMN1; SMN2NPC1RAB9AMAPTTSHR
SCHEMBL2558927 0.85 MAPT (0.46) SMN1; SMN2NPC1RAB9AMAPTLIPE
SCHEMBL2561997 0.85 MRGPRX4 (0.49) SMN1; SMN2NPC1RAB9AMAPTLIPE
SCHEMBL2560333 0.84 LIPE (0.53) SMN1; SMN2NPC1RAB9AMAPTTSHR
SCHEMBL2558164 0.83 KMT2A (0.47) SMN1; SMN2NPC1MAPTTSHRALDH1A1
SCHEMBL27814043 0.82 SMN1; SMN2 (0.51) SMN1; SMN2NPC1RAB9AMAPTTSHR
SCHEMBL2557287 0.82 LIPE (0.55) SMN1; SMN2NPC1RAB9AMAPTPTGDR2
SCHEMBL13794084 0.81 KDM4E (0.51) SMN1; SMN2NPC1RAB9AMAPTTSHR
SCHEMBL2559358 0.79 LIPE (0.44) SMN1; SMN2NPC1RAB9AMAPTTSHR

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