SCHEMBL2554380

SCHEMBL2554380

OB(O)c1cc(C(F)(F)F)cnc1-c1cccc(OC(F)(F)F)c1

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 10/20 0.44
KCNH2 Q12809 2/20 0.44
SCN10A Q9Y5Y9 1/20 0.44
PIM1 P11309 6/20 0.42
KCNA5 P22460 1/20 0.41
NPY5R Q15761 1/20 0.40
BTK Q06187 1/20 0.40

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
SCHEMBL2560373 0.86 DHODH (0.47) DYRK1AKCNH2SCN10APIM1KCNA5
SCHEMBL2556002 0.86 RAB9A (0.43) KCNH2SCN10A
SCHEMBL2559916 0.84 MGLL (0.46) DYRK1AKCNA5
SCHEMBL2560837 0.78 KCNH2 (0.43) DYRK1AKCNH2SCN10AKCNA5NPY5R
SCHEMBL2552695 0.77 MGLL (0.43) DYRK1A
SCHEMBL2560758 0.76 XDH (0.40) DYRK1AKCNH2SCN10AKCNA5
SCHEMBL2552141 0.76 DYRK1A (0.44) DYRK1AKCNH2SCN10AKCNA5NPY5R
SCHEMBL21352393 0.76 GPBAR1 (0.42)
SCHEMBL2555305 0.76 DYRK1A (0.47) DYRK1AKCNH2SCN10APIM1NPY5R
SCHEMBL15333421 0.75 DYRK1A (0.47) DYRK1AKCNH2SCN10APIM1NPY5R

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