SCHEMBL2558027

SCHEMBL2558027

CCC(C)n1cc(C=O)c(-c2sccc2Br)n1

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.33
NPC1 O15118 2/20 0.33
MAPT P10636 2/20 0.33
POLB P06746 1/20 0.33
PKM P14618 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
PTGS2 P35354 1/20 0.32
LMNA P02545 2/20 0.32
ACHE P22303 1/20 0.31
SMN1; SMN2 Q16637 2/20 0.30
DUSP3 P51452 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL2560791 0.88 RAB9A (0.34) RAB9ANPC1MAPTPOLBPKM
SCHEMBL15331394 0.87 PTGS2 (0.35) RAB9ANPC1MAPTPOLBPKM
SCHEMBL15330207 0.80 LMNA (0.41) RAB9ANPC1MAPTPOLBPKM
SCHEMBL15329616 0.80 PTGS2 (0.31) PTGS2
SCHEMBL15331607 0.80 LMNA (0.39) RAB9ANPC1MAPTPOLBPKM
SCHEMBL15333086 0.78 LMNA (0.38) RAB9ANPC1MAPTPOLBPKM
SCHEMBL15332377 0.78 LMNA (0.44) RAB9ANPC1MAPTPOLBPKM
SCHEMBL2559728 0.78 LMNA (0.42) RAB9ANPC1MAPTPOLBPKM
SCHEMBL15331196 0.76 LMNA (0.43) RAB9ANPC1MAPTPOLBPKM
SCHEMBL15331523 0.75 PTGS2 (0.34) RAB9ANPC1MAPTPOLBPKM

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