SCHEMBL2553979

SCHEMBL2553979

OB(O)c1cnc(-c2ccc(OCc3ccccc3)cc2)nc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.51
CYP1A2 P05177 1/20 0.51
PTGS1 P23219 1/20 0.51
SLC6A2 P23975 1/20 0.51
CYP2C19 P33261 1/20 0.51
PTGS2 P35354 1/20 0.51
SLC6A3 Q01959 1/20 0.51
HIF1A Q16665 1/20 0.51
HDAC6 Q9UBN7 1/20 0.51
MAOB P27338 5/20 0.50
NR4A1 P22736 1/20 0.50
NR4A2 P43354 1/20 0.50
NR4A3 Q92570 1/20 0.50
GSTP1 P09211 1/20 0.48
PARP10 Q53GL7 1/20 0.48
SRD5A2 P31213 1/20 0.47
GAA P10253 2/20 0.46
RAB9A P51151 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
MAPT P10636 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
SCHEMBL2559067 0.88 P4HTM (0.49) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL6534828 0.84 LMNA (0.62) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL9084030 0.83 DGAT1 (0.53) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL2555201 0.83 LMNA (0.59) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL142665 0.81 LMNA (0.66) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL8331353 0.81 NR4A2 (0.69) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL7092038 0.81 LMNA (0.67) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL8407027 0.80 LMNA (0.51) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL8612030 0.80 RAB9A (0.58) LMNACYP1A2PTGS1SLC6A2CYP2C19
SCHEMBL9424295 0.79 MAOB (0.53) LMNACYP1A2PTGS1SLC6A2CYP2C19

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 8 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
EP-0792870-A1 Process for the preparation of ketoximethers by coupling with boronic acid derivatives Hoechst Schering AgrEvo GmbH (DE) 1997-09-03 EP disclosed