SCHEMBL21068614

SCHEMBL21068614

CCOC(=O)COCCCCCOCCCOC1CCCCO1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.47
HRH1 P35367 1/20 0.34
CES2 O00748 2/20 0.33
CYP4F2 P78329 1/20 0.33
CYP4A11 Q02928 1/20 0.33
KDM4C Q9H3R0 1/20 0.32
ADORA3 P0DMS8 1/20 0.32

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
SCHEMBL22071027 0.97 KMT2A (0.49) KMT2AMEN1HRH1CES2KDM4C
SCHEMBL20548080 0.92 KMT2A (0.41) KMT2AMEN1HRH1CYP4F2CYP4A11
SCHEMBL22325517 0.88 MEN1 (0.48) KMT2AMEN1
SCHEMBL1263510 0.85 MEN1 (0.50) KMT2AMEN1
SCHEMBL11537124 0.85 MEN1 (0.50) KMT2AMEN1
SCHEMBL8003850 0.84 MEN1 (0.48) KMT2AMEN1
SCHEMBL374442 0.83 KMT2A (0.44) KMT2AMEN1
SCHEMBL7939089 0.83 MEN1 (0.50) KMT2AMEN1CES2KDM4C
SCHEMBL20547938 0.82 KMT2A (0.41) KMT2AMEN1KDM4CADORA3
SCHEMBL20547937 0.82 KMT2A (0.41) KMT2AMEN1KDM4CADORA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3727355-A1 COMPOUNDS AND THEIR USE IN TREATING CANCER AstraZeneca AB (SE) 2020-10-28 EP disclosed
US-20190194190-A1 Compounds and Their Use in Treating Cancer ASTRAZENECA PHARMACEUTICALS LP 2019-06-27 US disclosed
US-20190194190-A1 Compounds and Their Use in Treating Cancer ASTRAZENECA PHARMACEUTICALS LP 2019-06-27 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-20190194190-A1 Compounds and Their Use in Treating Cancer F12, CCNY, CCNE1 KMT2A 2404/4885MEN1 474/4885HRH1 1191/4885

“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.