SCHEMBL12082159

SCHEMBL12082159

CCCC(=O)NCCOCCOCCC(=O)NCCOCCOCCC(C)=O

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CASP2 P42575 1/20 0.46
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
CA12 O43570 2/20 0.38
CA1 P00915 2/20 0.38
CA2 P00918 2/20 0.38
CA4 P22748 2/20 0.38
CA9 Q16790 2/20 0.38
CA14 Q9ULX7 2/20 0.38
HPGD P15428 1/20 0.37
TSHR P16473 1/20 0.37
HDAC3 O15379 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC2 Q92769 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
CNR1 P21554 1/20 0.36
NAAA Q02083 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL13598098 0.98 CASP2 (0.47) CASP2MEN1KMT2ACA12CA1
SCHEMBL22910481 0.98 CASP2 (0.47) CASP2MEN1KMT2ACA12CA1
SCHEMBL12221919 0.96 CASP2 (0.48) CASP2MEN1KMT2AHPGDTSHR
SCHEMBL13598099 0.93 MEN1 (0.41) CASP2MEN1KMT2ACA12CA1
SCHEMBL20327891 0.93 MEN1 (0.41) CASP2MEN1KMT2ACA12CA1
SCHEMBL23157319 0.92 CASP2 (0.49) CASP2TSHRCNR1NAAASMN1; SMN2
SCHEMBL15132494 0.91 EPHX2 (0.41) CASP2MEN1KMT2ACA12CA1
SCHEMBL19658253 0.91 TSHR (0.42) CASP2MEN1KMT2ACA12CA1
SCHEMBL19369656 0.90 CASP2 (0.43) CASP2MEN1KMT2ATSHRCNR1
SCHEMBL14924287 0.90 MEN1 (0.44) CASP2MEN1KMT2ACA12CA1

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-8258259-B2 Macromolecular compounds having controlled stoichiometry STARPHARMA PTY LIMITED (AU) 2012-09-04 US disclosed
US-20090118467-A1 Macromolecular Compounds Having Controlled Stoichiometry STARPHARMA PTY LIMITED (AU) 2009-05-07 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 (1 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-20090118467-A1 Macromolecular Compounds Having Controlled Stoichiometry MICA, PICALM, CLTB CASP2 4306/4885MEN1 582/4885KMT2A 3445/4885

“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.