SCHEMBL2555360

SCHEMBL2555360

O=CCOc1cc(F)ccc1F

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CTSS P25774 3/20 0.53
CTSK P43235 3/20 0.53
CTSL P07711 2/20 0.53
MEN1 O00255 1/20 0.37
ALDH1A1 P00352 1/20 0.37
POLB P06746 1/20 0.37
HPGD P15428 1/20 0.37
KMT2A Q03164 1/20 0.37
ADRA1D P25100 2/20 0.36
CES2 O00748 1/20 0.35
CES1 P23141 1/20 0.35

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
SCHEMBL20578753 0.85 POLB (0.50) CTSSCTSKCTSLMEN1ALDH1A1
SCHEMBL3734649 0.81 ADRA1D (0.45) CTSSCTSKCTSLADRA1D
SCHEMBL98328 0.81 ADRA1D (0.40) CTSSCTSKCTSLADRA1D
SCHEMBL7623243 0.81 MAPT (0.49) ALDH1A1POLBHPGD
SCHEMBL9633635 0.80 TUBB1 (0.54) CTSSCTSKCTSLMEN1ALDH1A1
SCHEMBL249457 0.80 CTSS (0.60) CTSSCTSKCTSLMEN1ALDH1A1
SCHEMBL26020005 0.79 CTSS (0.41) CTSSCTSKCTSL
SCHEMBL3724878 0.78 NPC1 (0.46) CTSSCTSKCTSLMEN1ALDH1A1
SCHEMBL29863189 0.78 MRGPRX4 (0.47) CTSSCTSKCTSLMEN1ALDH1A1
SCHEMBL19086308 0.78 CTSL (0.43) CTSSCTSKCTSLMEN1ALDH1A1

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