SCHEMBL2552828

SCHEMBL2552828

O=Cc1c(Cl)nn(-c2cc(Cl)ccc2Cl)c1Cl

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.46
KDM4E B2RXH2 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
CDK4 P11802 1/20 0.38
CCND1 P24385 1/20 0.38
MAPT P10636 2/20 0.38
OPRM1 P35372 1/20 0.38
TDP1 Q9NUW8 1/20 0.37
PDE2A O00408 1/20 0.37
ESR1 P03372 1/20 0.36
ALDH1A1 P00352 3/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
MCOLN3 Q8TDD5 2/20 0.35
MAPK1 P28482 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
HPGD P15428 1/20 0.35
NOTUM Q6P988 2/20 0.33
TP53 P04637 1/20 0.33

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
SCHEMBL29958261 0.88 LMNA (0.43) L3MBTL1CDK4CCND1OPRM1TDP1
SCHEMBL2561030 0.88 LMNA (0.43) L3MBTL1CDK4CCND1OPRM1TDP1
SCHEMBL15332118 0.85 CDK4 (0.40) HTTKDM4EL3MBTL1CDK4CCND1
SCHEMBL15333179 0.81 SMN1; SMN2 (0.43) KDM4EL3MBTL1CDK4CCND1MAPT
SCHEMBL15332365 0.77 MAPT (0.43) L3MBTL1MAPTALDH1A1MEN1KMT2A
SCHEMBL2558724 0.76 GAA (0.41) HTTKDM4EL3MBTL1MAPTALDH1A1
SCHEMBL15331179 0.76 KMT2A (0.46) HTTKDM4EMAPTALDH1A1MEN1
SCHEMBL2561348 0.76 MARS1 (0.36) HTTALDH1A1MEN1KMT2A
SCHEMBL2561067 0.76 ESR1 (0.35) L3MBTL1CDK4CCND1ESR1
SCHEMBL2558937 0.76 HTT (0.41) HTTKDM4EL3MBTL1CDK4CCND1

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