SCHEMBL2560653

SCHEMBL2560653

Nc1cccc2oc(-c3ccc(C=O)cc3)nc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 8/20 0.42
RAB9A P51151 8/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
ATM Q13315 1/20 0.42
SMN1; SMN2 Q16637 5/20 0.39
HPGD P15428 4/20 0.39
ALDH1A1 P00352 3/20 0.39
KDM4E B2RXH2 2/20 0.39
TP53 P04637 2/20 0.39
HSD17B10 Q99714 2/20 0.39
F2RL3 Q96RI0 2/20 0.39
UTRN P46939 1/20 0.38
HIF1A Q16665 1/20 0.37
TOP2A P11388 1/20 0.36
GFER P55789 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
GLA P06280 1/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 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
SCHEMBL10825753 0.87 NPC1 (0.51) NPC1RAB9AMEN1KMT2AATM
SCHEMBL6399187 0.83 NPC1 (0.60) NPC1RAB9AMEN1KMT2AATM
SCHEMBL19391110 0.82 UTRN (0.43) NPC1RAB9AMEN1KMT2AATM
SCHEMBL11166470 0.82 CEPT1 (0.49) NPC1RAB9AMEN1KMT2AATM
SCHEMBL31433078 0.81 RAB9A (0.53) NPC1RAB9AMEN1KMT2AATM
SCHEMBL7109574 0.81 RAB9A (0.53) NPC1RAB9AMEN1KMT2AATM
SCHEMBL4147435 0.80 RAB9A (0.46) NPC1RAB9AMEN1KMT2AATM
SCHEMBL2249487 0.80 NPC1 (0.51) NPC1RAB9AMEN1KMT2AATM
SCHEMBL18935916 0.77 IKBKB (0.48) NPC1RAB9AMEN1KMT2AATM
SCHEMBL10279123 0.77 NPC1 (0.51) NPC1RAB9AMEN1KMT2AATM

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