SCHEMBL15330360

SCHEMBL15330360

CNC(=O)c1cc(N2CCCC(C=O)C2)ccn1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ USP30 Q70CQ3 1/20 0.45
▸ HRH4 Q9H3N8 9/20 0.41
▸ TP53BP1 Q12888 6/20 0.41
▸ NFKB1 P19838 2/20 0.40
▸ NR2C2 P49116 2/20 0.40
▸ NFKB2 Q00653 2/20 0.40
▸ RELA Q04206 2/20 0.40
▸ TAB1 Q15750 2/20 0.40
▸ ACACB O00763 1/20 0.38
▸ RAF1 P04049 1/20 0.37
▸ BRAF P15056 1/20 0.37

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
SCHEMBL29954544 0.88 USP30 (0.50) USP30HRH4TP53BP1ACACB
SCHEMBL2562359 0.86 USP30 (0.41) USP30HRH4TP53BP1
SCHEMBL2563476 0.86 USP30 (0.43) USP30HRH4TP53BP1NFKB1NR2C2
SCHEMBL18135099 0.80 NFKB1 (0.51) USP30HRH4TP53BP1NFKB1NR2C2
SCHEMBL2555517 0.76 USP30 (0.41) USP30TP53BP1NFKB1NR2C2NFKB2
SCHEMBL29951919 0.74 USP30 (0.48) USP30TP53BP1ACACB
SCHEMBL4687065 0.73 CHKA (0.52) —
SCHEMBL29115424 0.73 HRH4 (0.52) USP30HRH4TP53BP1NFKB1NR2C2
SCHEMBL29960561 0.73 HRH4 (0.52) USP30HRH4TP53BP1NFKB1NR2C2
SCHEMBL18135106 0.73 CTSA (0.56) TP53BP1

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 5 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
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