SCHEMBL21244014

SCHEMBL21244014

C=Cc1ccc(OCOCc2ccccc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.47
LCK P06239 1/20 0.46
LMNA P02545 2/20 0.46
CYP1A2 P05177 1/20 0.46
PTGS1 P23219 1/20 0.46
SLC6A2 P23975 1/20 0.46
CYP2C19 P33261 1/20 0.46
PTGS2 P35354 1/20 0.46
SLC6A3 Q01959 1/20 0.46
HIF1A Q16665 1/20 0.46
HDAC6 Q9UBN7 1/20 0.46
GSK3B P49841 2/20 0.45
BACE1 P56817 2/20 0.45
MAOB P27338 3/20 0.44
GAA P10253 2/20 0.44
MAPT P10636 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
RAB9A P51151 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
MAOA P21397 1/20 0.44

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
SCHEMBL763259 0.87 LMNA (0.60) TSHRLCKLMNACYP1A2PTGS1
SCHEMBL6536372 0.87 CHRNA7 (0.46) TSHRLCKLMNACYP1A2PTGS1
SCHEMBL2267205 0.85 TDP1 (0.46) TSHRLCKLMNACYP1A2PTGS1
SCHEMBL8751709 0.85 TSHR (0.64) TSHRLMNACYP1A2PTGS1SLC6A2
SCHEMBL14378813 0.83 TSHR (0.62) TSHRLCKALDH1A1KDM4E
SCHEMBL1480744 0.83 LMNA (0.55) LCKLMNACYP1A2PTGS1SLC6A2
SCHEMBL3158759 0.81 TSHR (0.64) TSHRLMNACYP1A2PTGS1SLC6A2
SCHEMBL2516876 0.80 APP (0.58) TSHRLCKLMNACYP1A2PTGS1
SCHEMBL197717 0.80 TSHR (0.56) TSHRLMNACYP1A2PTGS1SLC6A2
SCHEMBL18868385 0.79 ALDH1A1 (0.50) TSHRHIF1AMAPTALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11292859-B2 Method for producing a polymer by nitroxyl-controlled polymerisation, and polymer FRAUNHOFER-GESELLSCHAFT ZURFÖRDERUNG DER ANGEWANDTEN FORSCHUNG E.V. (DE) 2022-04-05 US claimed
US-20190248927-A1 METHOD FOR PRODUCING A POLYMER BY NITROXYL-CONTROLLED POLYMERISATION, AND POLYMER Fraunhofer-Gesellschaft zur Förderung der angewandten Forschung e. V. (DE) 2019-08-15 US claimed
CN-110100205-B Method for producing polymers by controlled nitrogen-oxygen polymerization and polymers 弗劳恩霍夫应用研究促进协会 2022-12-30 CN disclosed
US-11292859-B2 Method for producing a polymer by nitroxyl-controlled polymerisation, and polymer FRAUNHOFER-GESELLSCHAFT ZURFÖRDERUNG DER ANGEWANDTEN FORSCHUNG E.V. (DE) 2022-04-05 US disclosed
US-20190248927-A1 METHOD FOR PRODUCING A POLYMER BY NITROXYL-CONTROLLED POLYMERISATION, AND POLYMER Fraunhofer-Gesellschaft zur Förderung der angewandten Forschung e. V. (DE) 2019-08-15 US disclosed