SCHEMBL10330491

SCHEMBL10330491

C=C(C)C(=O)OCC(O)CN(CCCCCC)CCCCCC

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.53
KDM4E B2RXH2 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
DUSP3 P51452 1/20 0.41
LMNA P02545 1/20 0.41
MAPK1 P28482 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
ENPP2 Q13822 2/20 0.37
LPAR6 P43657 1/20 0.37
LPAR1 Q92633 1/20 0.37
LPAR4 Q99677 1/20 0.37
LPAR5 Q9H1C0 1/20 0.37
LPAR2 Q9HBW0 1/20 0.37
LPAR3 Q9UBY5 1/20 0.37
MAPT P10636 1/20 0.36
POLB P06746 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
DGKA P23743 1/20 0.36
THRB P10828 1/20 0.36

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
SCHEMBL8432931 0.94 TSHR (0.47) TSHRKDM4EMEN1KMT2ADUSP3
SCHEMBL11882411 0.88 TSHR (0.44) TSHRKDM4EMEN1KMT2ADUSP3
SCHEMBL8764057 0.88 TSHR (0.50) TSHRKDM4EMEN1KMT2ADUSP3
SCHEMBL11628856 0.87 TSHR (0.60) TSHRKDM4EMEN1KMT2ADUSP3
SCHEMBL8421411 0.85 TSHR (0.45) TSHRKDM4EMEN1KMT2ALMNA
SCHEMBL4993413 0.84 TSHR (0.50) TSHRKDM4EMEN1KMT2ADUSP3
SCHEMBL9498035 0.84 TSHR (0.53) TSHRKDM4EMEN1KMT2ADUSP3
SCHEMBL29009582 0.84 TSHR (0.57) TSHRKDM4EMEN1KMT2ADUSP3
SCHEMBL3972903 0.83 TSHR (0.49) TSHRKDM4EMEN1KMT2ADUSP3
SCHEMBL1254411 0.83 TSHR (0.52) TSHRKDM4EMEN1KMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2556128-B1 CROSSLINKABLE SYRUP COPOLYMERS WITH AMINOALKYL (METH)ACRYLOYL SOLVENT MONOMERS 3M INNOVATIVE PROPERTIES CO (US) 2014-06-04 EP disclosed
US-8404778-B2 Crosslinkable syrup copolymers with aminoalkyl (meth)acryloyl solvent monomers 3M INNOVATIVE PROPERTIES COMPANY (US) 2013-03-26 US disclosed
US-8404778-B2 Crosslinkable syrup copolymers with aminoalkyl (meth)acryloyl solvent monomers 3M INNOVATIVE PROPERTIES COMPANY (US) 2013-03-26 US disclosed
US-20120252980-A1 CROSSLINKABLE SYRUP COPOLYMERS WITH AMINOALKYL (METH)ACRYLOYL SOLVENT MONOMERS 3M INNOVATIVE PROPERTIES COMPANY 2012-10-04 US disclosed
US-20120252980-A1 CROSSLINKABLE SYRUP COPOLYMERS WITH AMINOALKYL (METH)ACRYLOYL SOLVENT MONOMERS 3M INNOVATIVE PROPERTIES COMPANY 2012-10-04 US disclosed
US-8222340-B2 Crosslinkable syrup copolymers with aminoalkyl (meth)acryloyl solvent monomers 3M INNOVATIVE PROPERTIES COMPANY (US) 2012-07-17 US disclosed
US-8222340-B2 Crosslinkable syrup copolymers with aminoalkyl (meth)acryloyl solvent monomers 3M INNOVATIVE PROPERTIES COMPANY (US) 2012-07-17 US disclosed
US-20110244231-A1 CROSSLINKABLE SYRUP SOLUTE COPOLYMERS WITH AMINOALKYL (METH)ACRYLOYL SOLVENT MONOMERS 3M INNOVATIVE PROPERTIES COMPANY 2011-10-06 US disclosed
US-20110244231-A1 CROSSLINKABLE SYRUP SOLUTE COPOLYMERS WITH AMINOALKYL (METH)ACRYLOYL SOLVENT MONOMERS 3M INNOVATIVE PROPERTIES COMPANY 2011-10-06 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120252980-A1 CROSSLINKABLE SYRUP COPOLYMERS WITH AMINOALKYL (METH)ACRYLOYL SOLVENT MONOMERS ACR, AASDHPPT, ICAM1 TSHR 4835/4885KDM4E 3706/4885MEN1 392/4885
US-20110244231-A1 CROSSLINKABLE SYRUP SOLUTE COPOLYMERS WITH AMINOALKYL (METH)ACRYLOYL SOLVENT MONOMERS ACR, AASDHPPT, ICAM1 TSHR 4797/4885KDM4E 4087/4885MEN1 405/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.