SCHEMBL7184205

SCHEMBL7184205

C=C(C)C(=O)OC(C)N1CCN(C(=O)C(=C)C)C1=O

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.32
KMT2A Q03164 1/20 0.30
ATM Q13315 1/20 0.30

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
SCHEMBL4184795 0.76 TDP1 (0.32)
SCHEMBL6856640 0.72 TSHR (0.33) TSHRKMT2AATM
SCHEMBL4154528 0.72 LMNA (0.44) TSHRKMT2AATM
SCHEMBL8509551 0.72
SCHEMBL7180659 0.72 TSHR (0.33) TSHR
SCHEMBL3883739 0.71 TSHR (0.41) TSHRKMT2AATM
SCHEMBL7136150 0.71 KDM4E (0.39) TSHRKMT2AATM
SCHEMBL19145906 0.70 LMNA (0.39) TSHRKMT2AATM
SCHEMBL8578110 0.70 TSHR (0.39) TSHRKMT2AATM
SCHEMBL2036449 0.69 KMT2A (0.43) TSHRKMT2AATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6541658-B2 Process for synthesis of (meth) acrylic acid esters by transesterification in the presence of mixed catalysts containing alkali metal cyanate or thiocyanate ROEHM GMBH & CO., KG (DE) 2003-04-01 US disclosed
US-20020111511-A1 Process for synthesis of (meth) acrylic acid esters by transesterification in the presence of mixed catalysts containing alkali metal cyanate or thiocyanate ROEHM GMBH & CO. KG (DE) 2002-08-15 US disclosed