SCHEMBL2554088

SCHEMBL2554088

Cc1cc(C)c2c(C=O)c(-c3ccc(F)cc3F)[nH]c2c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
MEN1 O00255 1/20 0.39
THRB P10828 1/20 0.39
HPGD P15428 1/20 0.39
KMT2A Q03164 1/20 0.39
DHODH Q02127 2/20 0.38
ERN1 O75460 1/20 0.37
PIM1 P11309 1/20 0.34
PIM3 Q86V86 1/20 0.34
AR P10275 2/20 0.34
PARP1 P09874 1/20 0.33
PTGS1 P23219 1/20 0.32
PTGS2 P35354 1/20 0.32
GRIN2D O15399 1/20 0.32
GRIN3B O60391 1/20 0.32
GRIN1 Q05586 1/20 0.32
GRIN2A Q12879 1/20 0.32
GRIN2B Q13224 1/20 0.32
GRIN2C Q14957 1/20 0.32
GRIN3A Q8TCU5 1/20 0.32

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
SCHEMBL15330961 0.90 ERN1 (0.37) ALDH1A1MEN1THRBHPGDKMT2A
SCHEMBL15332499 0.86 TNKS (0.41) MEN1KMT2ADHODHERN1GRIN2D
SCHEMBL29955999 0.83 TNKS2 (0.40) ALDH1A1ERN1PTGS2GRIN2DGRIN3B
SCHEMBL2559317 0.82 PIM1 (0.37) ALDH1A1MEN1THRBHPGDKMT2A
SCHEMBL2561650 0.81 DHODH (0.39) MEN1KMT2ADHODHERN1PARP1
SCHEMBL15332851 0.80 ERN1 (0.38) MEN1KMT2ADHODHERN1GRIN2D
SCHEMBL29953545 0.80 TNKS2 (0.44) ALDH1A1HPGDDHODHERN1AR
SCHEMBL2562653 0.80 MEN1 (0.41) ALDH1A1MEN1THRBHPGDKMT2A
SCHEMBL2560752 0.79 KDM4E (0.36) ALDH1A1MEN1THRBHPGDKMT2A
SCHEMBL2554515 0.79 ERN1 (0.39) MEN1KMT2ADHODHERN1PARP1

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