SCHEMBL2558629

SCHEMBL2558629

Cc1cc(F)c2[nH]c(-c3ccc(F)cc3F)c(C=O)c2c1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.42
MEN1 O00255 1/20 0.42
THRB P10828 1/20 0.42
HPGD P15428 1/20 0.42
KMT2A Q03164 1/20 0.42
PIM1 P11309 1/20 0.37
PIM3 Q86V86 1/20 0.37
APOL1 O14791 5/20 0.36
DHODH Q02127 2/20 0.36
PTGS1 P23219 1/20 0.35
PTGS2 P35354 1/20 0.35
AR P10275 1/20 0.34
MAPK13 O15264 1/20 0.33
MAPK12 P53778 1/20 0.33
MAPK11 Q15759 1/20 0.33
MAPK14 Q16539 1/20 0.33
NFE2L2 Q16236 1/20 0.33
HTT P42858 1/20 0.32
KDM4E B2RXH2 1/20 0.31
KIT P10721 1/20 0.31

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
SCHEMBL2562653 0.91 MEN1 (0.41) ALDH1A1MEN1THRBHPGDKMT2A
SCHEMBL2561431 0.90 APOL1 (0.36) ALDH1A1MEN1THRBHPGDKMT2A
SCHEMBL2577085 0.89 APOL1 (0.40) PIM1PIM3APOL1MAPK13MAPK12
SCHEMBL15331396 0.85 TNKS (0.39) ALDH1A1PIM1PIM3APOL1DHODH
SCHEMBL15332815 0.84 APOL1 (0.46) ALDH1A1APOL1
SCHEMBL15332781 0.83 TNKS (0.36) ALDH1A1MEN1KMT2AAPOL1DHODH
SCHEMBL15331509 0.82 ALDH1A1 (0.57) ALDH1A1MEN1THRBHPGDKMT2A
SCHEMBL15330343 0.81 MAPK13 (0.42) ALDH1A1MEN1THRBHPGDKMT2A
SCHEMBL2562716 0.81 APOL1 (0.39) ALDH1A1APOL1DHODH
SCHEMBL15332902 0.81 DHODH (0.37) APOL1DHODH

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