SCHEMBL2553097

SCHEMBL2553097

O=Cc1cnn(-c2cc(Cl)ccc2Cl)c1Cl

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.44
HTT P42858 1/20 0.40
ERN1 O75460 1/20 0.39
MAPT P10636 2/20 0.38
PDE9A O76083 1/20 0.37
KDM4E B2RXH2 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
PKM P14618 1/20 0.36
LMNA P02545 3/20 0.36
NPSR1 Q6W5P4 2/20 0.36
ALDH1A1 P00352 2/20 0.36
HPGD P15428 2/20 0.36
ALOX12 P18054 1/20 0.36
THRB P10828 1/20 0.36
OPRM1 P35372 1/20 0.35
ESR1 P03372 1/20 0.34
CDK4 P11802 1/20 0.33
CCND1 P24385 1/20 0.33
NOTUM Q6P988 1/20 0.33
JAK2 O60674 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
SCHEMBL15332944 0.88 TDP1 (0.49) TDP1ERN1L3MBTL1PKMLMNA
SCHEMBL15331537 0.85 ALDH1A1 (0.37) TDP1HTTKDM4ELMNANPSR1
SCHEMBL15330442 0.85 TDP1 (0.42) TDP1HTTERN1MAPTPDE9A
SCHEMBL30121896 0.81 PKM (0.46) TDP1HTTMAPTPKMLMNA
SCHEMBL15332588 0.81 PKM (0.46) TDP1HTTMAPTPKMLMNA
SCHEMBL15332330 0.77 NPC1 (0.44) TDP1MAPTKDM4EPKMLMNA
SCHEMBL15331298 0.76 LMNA (0.43) HTTMAPTKDM4EL3MBTL1LMNA
SCHEMBL15332027 0.76 NPC1 (0.48) HTTMAPTPKMHPGDMEN1
SCHEMBL15331857 0.76 CYP17A1 (0.40) HTTKDM4EPKMLMNANPSR1
SCHEMBL2562286 0.76 MAPK14 (0.35) TDP1HTTERN1KDM4EL3MBTL1

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