SCHEMBL2560249

SCHEMBL2560249

O=Cc1cc(Cl)ccc1OCc1sccc1Br

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.39
ALDH1A1 P00352 2/20 0.39
PKM P14618 1/20 0.39
PTGDR2 Q9Y5Y4 1/20 0.38
ERN1 O75460 3/20 0.38
S1PR4 O95977 2/20 0.36
MAPT P10636 1/20 0.36
CCR5 P51681 2/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
HPGD P15428 1/20 0.35
TSHR P16473 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
POLB P06746 1/20 0.34
RECQL P46063 1/20 0.34

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
SCHEMBL29951898 0.86 PTGDR2 (0.52) ALDH1A1PTGDR2ERN1MAPTCCR5
SCHEMBL2556665 0.82 RAB9A (0.45) KDM4EALDH1A1PTGDR2ERN1MAPT
SCHEMBL29951423 0.81 ALDH1A1 (0.53) KDM4EALDH1A1PTGDR2MAPTMEN1
SCHEMBL2556243 0.80 ERN1 (0.42) KDM4EALDH1A1PKMPTGDR2ERN1
SCHEMBL29952525 0.79 ALDH1A1 (0.41) ALDH1A1MAPTMEN1KMT2AHPGD
SCHEMBL2561409 0.77 PTGDR2 (0.42) KDM4EALDH1A1PKMPTGDR2ERN1
SCHEMBL29951459 0.77 ALDH1A1 (0.44) ALDH1A1MAPTMEN1KMT2AHPGD
SCHEMBL29227218 0.75 CCR5 (0.56) KDM4EPTGDR2MAPTCCR5KMT2A
SCHEMBL2554826 0.74 ALDH1A1 (0.52) ALDH1A1ERN1MAPTMEN1KMT2A
SCHEMBL2559995 0.73 ALDH1A1 (0.55) ALDH1A1MAPTMEN1KMT2AHPGD

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