SCHEMBL15329359

SCHEMBL15329359

OB(O)c1cccc(OCCN2CCCOCC2)c1

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.56
TSHR P16473 2/20 0.56
TP53 P04637 1/20 0.56
ALDH1A1 P00352 5/20 0.51
HTT P42858 1/20 0.51
SMN1; SMN2 Q16637 2/20 0.50
NPSR1 Q6W5P4 1/20 0.50
LTA4H P09960 1/20 0.49
NPC1 O15118 2/20 0.48
RAB9A P51151 1/20 0.48
BACE1 P56817 1/20 0.48
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47

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
SCHEMBL2555039 0.95 KDM4E (0.60) KDM4ETSHRTP53ALDH1A1HTT
SCHEMBL29951665 0.88 LTA4H (0.61) KDM4ETSHRALDH1A1HTTSMN1; SMN2
SCHEMBL29957497 0.87 BACE1 (0.62) KDM4ETSHRALDH1A1HTTSMN1; SMN2
SCHEMBL29957034 0.87 BACE1 (0.62) KDM4ETSHRALDH1A1HTTSMN1; SMN2
SCHEMBL2555773 0.85 NPC1 (0.56) KDM4ETSHRALDH1A1SMN1; SMN2LTA4H
SCHEMBL2821196 0.82 KDM4E (0.62) KDM4ETSHRALDH1A1SMN1; SMN2MEN1
SCHEMBL24862351 0.81 KDM4E (0.65) KDM4ETSHRTP53ALDH1A1HTT
SCHEMBL2557377 0.81 KMT2A (0.63) KDM4EALDH1A1HTTSMN1; SMN2LTA4H
SCHEMBL2558114 0.81 LTA4H (0.49) KDM4ETSHRALDH1A1HTTSMN1; SMN2
SCHEMBL14578276 0.80 ALDH1A1 (0.69) KDM4ETSHRTP53ALDH1A1HTT

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 5 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