SCHEMBL2563476

SCHEMBL2563476

CNC(=O)c1cc(N2CCC(C=O)CC2)ccn1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ USP30 Q70CQ3 1/20 0.43
▸ TP53BP1 Q12888 3/20 0.40
▸ CTSA P10619 1/20 0.39
▸ NFKB1 P19838 2/20 0.38
▸ NR2C2 P49116 2/20 0.38
▸ NFKB2 Q00653 2/20 0.38
▸ RELA Q04206 2/20 0.38
▸ TAB1 Q15750 2/20 0.38
▸ KDR P35968 2/20 0.38
▸ ACACB O00763 1/20 0.38
▸ HRH4 Q9H3N8 7/20 0.37
▸ KIT P10721 1/20 0.37
▸ FLT4 P35916 1/20 0.37
▸ RAF1 P04049 1/20 0.37
▸ BRAF P15056 1/20 0.37
▸ JAK1 P23458 1/20 0.36
▸ HTR1A P08908 1/20 0.36
▸ DRD2 P14416 1/20 0.36
▸ HTR2A P28223 1/20 0.36

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
SCHEMBL29951919 0.87 USP30 (0.48) USP30TP53BP1CTSAACACBHTR1A
SCHEMBL15330360 0.86 USP30 (0.45) USP30TP53BP1NFKB1NR2C2NFKB2
SCHEMBL2563048 0.84 USP30 (0.39) USP30TP53BP1
SCHEMBL18135099 0.81 NFKB1 (0.51) USP30TP53BP1CTSANFKB1NR2C2
SCHEMBL29115424 0.79 HRH4 (0.52) USP30TP53BP1CTSANFKB1NR2C2
SCHEMBL18135106 0.79 CTSA (0.56) TP53BP1CTSAJAK1
SCHEMBL29960561 0.79 HRH4 (0.52) USP30TP53BP1CTSANFKB1NR2C2
Hydrochloric Acid SCHEMBL900436 0.78 HRH4 (0.51) USP30TP53BP1CTSAHRH4HTR1A
SCHEMBL2555517 0.77 USP30 (0.41) USP30TP53BP1NFKB1NR2C2NFKB2
SCHEMBL29132185 0.74 HRH4 (0.35) HRH4

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
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