SCHEMBL2555346

SCHEMBL2555346

O=Cc1cccc(OC2CCCCNC2=O)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 1/20 0.38
DDB1 Q16531 3/20 0.38
CRBN Q96SW2 3/20 0.38
MAOA P21397 7/20 0.37
MAOB P27338 7/20 0.37
GAA P10253 1/20 0.36
NPC1 O15118 3/20 0.35
RAB9A P51151 3/20 0.35
CASP3 P42574 1/20 0.35
SENP8 Q96LD8 1/20 0.35
SENP7 Q9BQF6 1/20 0.35
SENP6 Q9GZR1 1/20 0.35
TLR4 O00206 1/20 0.34
TLR2 O60603 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
TRPM8 Q7Z2W7 1/20 0.33
PSEN1 P49768 1/20 0.33
PSEN2 P49810 1/20 0.33
APH1B Q8WW43 1/20 0.33
NCSTN Q92542 1/20 0.33

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
SCHEMBL29956283 0.83 ALDH1A1 (0.43) DDB1CRBN
SCHEMBL29954892 0.76 ALDH1A1 (0.50) NPC1TDP1
SCHEMBL29954114 0.76 PDE4B (0.51) NPC1TDP1
SCHEMBL3893959 0.75 SRC (0.47) SRCMAOAMAOBGAANPC1
SCHEMBL29954512 0.75 SRC (0.37) SRCMAOAGAANPC1RAB9A
SCHEMBL3748275 0.74 SRC (0.46) SRCMAOAMAOBGAANPC1
SCHEMBL5744737 0.74 SRC (0.46) SRCMAOAMAOBGAANPC1
SCHEMBL20832646 0.74 SMN1; SMN2 (0.51) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL30602665 0.74 SMN1; SMN2 (0.51) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL21459754 0.74 SRC (0.49) SRCMAOAMAOBGAANPC1

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