SCHEMBL2556848

SCHEMBL2556848

Cc1cc(C)c2[nH]c(-c3cccc(Cl)c3)c(C=O)c2c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.39
PTGES O14684 1/20 0.39
ABCB1 P08183 1/20 0.38
MAPT P10636 1/20 0.37
MGAM O43451 1/20 0.36
GAA P10253 1/20 0.36
SI P14410 1/20 0.36
MGAM2 Q2M2H8 1/20 0.36
PTGS2 P35354 1/20 0.36
ESR2 Q92731 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
TGFBR1 P36897 1/20 0.35
TGFBR2 P37173 1/20 0.35
PIN1 Q13526 1/20 0.34
NR3C1 P04150 1/20 0.34
PGR P06401 1/20 0.34
NR3C2 P08235 1/20 0.34
AR P10275 1/20 0.34
DRD2 P14416 1/20 0.34
DRD4 P21917 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
SCHEMBL29955733 0.88 ABCB1 (0.40) ALOX5PTGESABCB1MAPTSMN1; SMN2
SCHEMBL15333163 0.88 ALOX5 (0.38) ALOX5PTGESMGAMGAASI
SCHEMBL15330627 0.87 ALOX5 (0.43) ALOX5PTGESMAPTMGAMGAA
SCHEMBL15330604 0.85 MAPT (0.40) ALOX5PTGESABCB1MAPTPTGS2
SCHEMBL29951636 0.85 TNKS2 (0.44) ABCB1MAPTMGAMGAASI
SCHEMBL2557473 0.82 ALOX5 (0.39) ALOX5PTGESMAPTMGAMGAA
SCHEMBL29951123 0.81 MAPT (0.42) ABCB1MAPTMGAMGAASI
SCHEMBL29957073 0.81 SMN1; SMN2 (0.50) MAPTGAASMN1; SMN2PGRDRD2
SCHEMBL15331470 0.81 ALOX5 (0.46) ALOX5MAPTPTGS2SMN1; SMN2
SCHEMBL15329748 0.81 ERN1 (0.40) ABCB1MAPTMGAMGAASI

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