SCHEMBL2562705

SCHEMBL2562705

COc1cccc(C=O)c1OCc1ccc(C(=O)O)o1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.59
MEN1 O00255 2/20 0.59
NPC1 O15118 5/20 0.53
RAB9A P51151 5/20 0.53
POLB P06746 6/20 0.52
TDP1 Q9NUW8 4/20 0.52
MAPT P10636 3/20 0.52
L3MBTL1 Q9Y468 3/20 0.52
SMN1; SMN2 Q16637 4/20 0.52
ALDH1A1 P00352 4/20 0.52
CYP1A2 P05177 1/20 0.49
CYP2C19 P33261 1/20 0.49
SENP8 Q96LD8 1/20 0.48
SENP7 Q9BQF6 1/20 0.48
SENP6 Q9GZR1 1/20 0.48
MAPK1 P28482 1/20 0.48
TSHR P16473 1/20 0.46
HSD17B10 Q99714 1/20 0.46
LMNA P02545 1/20 0.46
SRC P12931 1/20 0.46

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
SCHEMBL15330107 0.82 KMT2A (0.74) KMT2AMEN1NPC1RAB9APOLB
SCHEMBL29952390 0.81 KMT2A (0.64) KMT2AMEN1NPC1RAB9APOLB
SCHEMBL28129638 0.78 KDM4E (0.60) NPC1RAB9AL3MBTL1SRC
SCHEMBL1125006 0.78 KDM4E (0.60) NPC1RAB9AL3MBTL1SRC
SCHEMBL2554736 0.75 PTGDR2 (0.62) KMT2AMEN1NPC1RAB9APOLB
SCHEMBL10900536 0.72 NPC1 (0.54) KMT2ANPC1RAB9ATDP1MAPT
SCHEMBL18740747 0.72 ERN1 (0.54) KMT2AMEN1NPC1RAB9APOLB
SCHEMBL1125257 0.72 SRC (0.58) KMT2AMEN1NPC1RAB9APOLB
SCHEMBL15330537 0.71 SRC (0.55) KMT2ANPC1RAB9APOLBSMN1; SMN2
SCHEMBL7357540 0.71 NPC1 (0.59) NPC1RAB9APOLBMAPTL3MBTL1

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