SCHEMBL21152802

SCHEMBL21152802

CCC(C)C(=O)CCC(=O)NCCOCCOCCOCCOCCC(=O)C(C)C

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
CA12 O43570 4/20 0.36
CA1 P00915 4/20 0.36
CA2 P00918 4/20 0.36
CA4 P22748 4/20 0.36
CA9 Q16790 4/20 0.36
CA14 Q9ULX7 4/20 0.36
ALDH1A1 P00352 1/20 0.33
GLP1R P43220 8/20 0.32
TSHR P16473 1/20 0.32
ADRB2 P07550 1/20 0.30
HTR1A P08908 1/20 0.30
KDM4E B2RXH2 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
SCHEMBL21099939 0.94 MEN1 (0.40) MEN1KMT2ACA12CA1CA2
SCHEMBL20226534 0.91 MEN1 (0.49) MEN1KMT2ACA12CA1CA2
SCHEMBL25812337 0.89 MEN1 (0.46) MEN1KMT2ACA12CA1CA2
SCHEMBL24812854 0.88 MEN1 (0.44) MEN1KMT2ACA12CA1CA2
SCHEMBL19004791 0.88 MEN1 (0.52) MEN1KMT2ACA12CA1CA2
SCHEMBL23386933 0.86 MEN1 (0.50) MEN1KMT2ACA12CA1CA2
SCHEMBL19491599 0.85 MEN1 (0.46) MEN1KMT2ACA12CA1CA2
SCHEMBL21043286 0.85 MEN1 (0.46) MEN1KMT2ACA12CA1CA2
SCHEMBL26412077 0.85 MEN1 (0.47) MEN1KMT2ACA12CA1CA2
SCHEMBL20848091 0.84 MEN1 (0.33) MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190209702-A1 STEROIDS AND ANTIBODY-CONJUGATES THEREOF REGENERON PHARMACEUTICALS, INC. 2019-07-11 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-20190209702-A1 STEROIDS AND ANTIBODY-CONJUGATES THEREOF SERPINA6, NR3C1, NR3C2 MEN1 2331/4885KMT2A 4385/4885CA12 2282/4885

“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.