SCHEMBL2555112

SCHEMBL2555112

O=Cc1ccc(OCc2cc(C(=O)O)co2)cc1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.46
DAO P14920 3/20 0.45
ALDH1A1 P00352 3/20 0.45
RAB9A P51151 4/20 0.43
SRD5A2 P31213 1/20 0.41
NR4A2 P43354 2/20 0.41
NR4A1 P22736 1/20 0.41
NR4A3 Q92570 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.40
KDM4E B2RXH2 1/20 0.40
PTGER4 P35408 1/20 0.40
NPC1 O15118 3/20 0.39
TDP1 Q9NUW8 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
APEX1 P27695 1/20 0.39
MAPK1 P28482 1/20 0.39
KMT2A Q03164 1/20 0.39
HSD17B10 Q99714 1/20 0.39

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
SCHEMBL2560715 0.85 MAOA (0.55) POLBDAOALDH1A1RAB9ASRD5A2
SCHEMBL2559526 0.82 MAOB (0.54) POLBALDH1A1SMN1; SMN2PTGER4L3MBTL1
SCHEMBL2562273 0.81 MRGPRX4 (0.45) POLBALDH1A1RAB9ASMN1; SMN2NPC1
SCHEMBL2560612 0.75 RAB9A (0.45) POLBALDH1A1RAB9ASMN1; SMN2KDM4E
SCHEMBL18259995 0.75 NR4A2 (0.68) POLBALDH1A1RAB9ASRD5A2NR4A2
SCHEMBL2558683 0.75 NR4A2 (0.68) POLBALDH1A1RAB9ASRD5A2NR4A2
SCHEMBL2555388 0.74 POLB (0.71) POLBALDH1A1RAB9ASMN1; SMN2KDM4E
SCHEMBL28941947 0.73 MRGPRX4 (0.70) RAB9ASMN1; SMN2
SCHEMBL29953186 0.73 MRGPRX4 (0.70) RAB9ASMN1; SMN2
SCHEMBL2558882 0.73 MAOB (0.60) SRD5A2NR4A2NR4A1NR4A3KMT2A

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