SCHEMBL4074959

SCHEMBL4074959

C=CCC=C(C#N)C(=O)OCCCC

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 3/20 0.46
TSHR P16473 3/20 0.45
HPGD P15428 2/20 0.45
DNM1 Q05193 3/20 0.41
MAPT P10636 3/20 0.40
MEN1 O00255 2/20 0.40
LMNA P02545 2/20 0.40
GAA P10253 2/20 0.40
KMT2A Q03164 2/20 0.40
KDM4E B2RXH2 2/20 0.40
NPC1 O15118 1/20 0.40
USP2 O75604 1/20 0.40
THRB P10828 1/20 0.40
HTT P42858 1/20 0.40
RAB9A P51151 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
MCOLN3 Q8TDD5 1/20 0.40
CYP2C9 P11712 2/20 0.40
ATM Q13315 1/20 0.40

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
SCHEMBL7737783 0.84 TP53 (0.46) TP53TSHRHPGDDNM1MAPT
SCHEMBL7737784 0.84 TP53 (0.46) TP53TSHRHPGDDNM1MAPT
SCHEMBL541315 0.84 CYP2C9 (0.56) TP53TSHRHPGDMAPTMEN1
SCHEMBL7745797 0.83 TP53 (0.45) TP53TSHRHPGDDNM1MAPT
SCHEMBL7737755 0.83 TP53 (0.45) TP53TSHRHPGDDNM1MAPT
SCHEMBL7745794 0.83 TP53 (0.45) TP53TSHRHPGDDNM1MAPT
SCHEMBL7737758 0.83 TP53 (0.45) TP53TSHRHPGDDNM1MAPT
SCHEMBL7743874 0.82 TP53 (0.49) TP53TSHRHPGDDNM1MAPT
SCHEMBL7547816 0.82 TP53 (0.49) TP53TSHRHPGDDNM1MAPT
SCHEMBL11123619 0.81 TSHR (0.47) TP53TSHRHPGDDNM1MAPT

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-7482504-B2 Dressing for treatment of short wounds located in high tension areas ZYMURGY, LLC (US) 2009-01-27 US disclosed
WO-2005107668-A2 DRESSING AND METHOD OF TREATMENT FOR A WOUND ZYMURGY, LLC (US) 2005-11-17 WO disclosed
WO-2005107669-A2 DRESSING AND METHOD OF TREATMENT FOR A WOUND ZYMURGY, LLC (US) 2005-11-17 WO disclosed
US-20050245855-A1 Dressing and method of treatment for a wound ZYMURGY, LLC 2005-11-03 US disclosed
US-20050244366-A1 Dressing and method of treatment for a wound ZYMURGY, LLC 2005-11-03 US disclosed