SCHEMBL2556784

SCHEMBL2556784

COc1ccc(-c2nc3ccc(Br)cn3c2C=O)cc1OC

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRNP P04156 3/20 0.55
KDM4E B2RXH2 4/20 0.46
ALDH1A1 P00352 4/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
NPC1 O15118 3/20 0.46
RAB9A P51151 3/20 0.46
BACE1 P56817 2/20 0.46
TRIM33 Q9UPN9 2/20 0.45
PSMD14 O00487 1/20 0.44
LMNA P02545 1/20 0.43
RXFP1 Q9HBX9 1/20 0.43
PIK3CA P42336 1/20 0.43
MTOR P42345 1/20 0.43
NR1H4 Q96RI1 1/20 0.43
ALOX5 P09917 1/20 0.43
TRIM24 O15164 2/20 0.42
RAD52 P43351 1/20 0.41
ERN1 O75460 1/20 0.40
TP53 P04637 1/20 0.40
MAPT P10636 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
SCHEMBL29956421 1.00 PRNP (0.55) PRNPKDM4EALDH1A1SMN1; SMN2NPC1
SCHEMBL15332882 0.86 KDM4E (0.59) PRNPKDM4EALDH1A1SMN1; SMN2NPC1
SCHEMBL15331325 0.84 RAB9A (0.65) KDM4EALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL15330450 0.82 SLC2A1 (0.53) PRNPKDM4EALDH1A1SMN1; SMN2NPC1
SCHEMBL15332956 0.82 NPC1 (0.50) PRNPKDM4EALDH1A1SMN1; SMN2NPC1
SCHEMBL15332593 0.77 SLC2A1 (0.51) KDM4EALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL29951865 0.77 NPC1 (0.52) PRNPKDM4EALDH1A1SMN1; SMN2NPC1
SCHEMBL5421256 0.77 ALDH1A1 (0.63) PRNPKDM4EALDH1A1SMN1; SMN2NPC1
SCHEMBL29956631 0.77 NPC1 (0.51) PRNPKDM4EALDH1A1SMN1; SMN2NPC1
SCHEMBL15176054 0.76 SMN1; SMN2 (0.54) PRNPKDM4EALDH1A1SMN1; SMN2NPC1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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