SCHEMBL10289647

SCHEMBL10289647

CCOOCC1C(=O)N([C@@H](C)c2ccccc2)C[C@H]1C1(CI)CC1

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.35
HSD11B1 P28845 2/20 0.33
ALDH1A1 P00352 1/20 0.32
HPGD P15428 1/20 0.32
MAPK1 P28482 2/20 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
SCHEMBL10289932 0.90 KMT2A (0.37) KMT2AHSD11B1ALDH1A1HPGDMAPK1
SCHEMBL4748644 0.87 KMT2A (0.39) KMT2AHSD11B1ALDH1A1HPGDMAPK1
SCHEMBL4792235 0.80 KMT2A (0.31) KMT2A
SCHEMBL4794570 0.80 KMT2A (0.40) KMT2AHSD11B1ALDH1A1HPGDMAPK1
SCHEMBL2670055 0.79 ALDH1A1 (0.40) KMT2AHSD11B1ALDH1A1HPGD
SCHEMBL10289649 0.77 KMT2A (0.33) KMT2AHSD11B1
SCHEMBL10306165 0.77 KMT2A (0.38) KMT2AHSD11B1ALDH1A1HPGDMAPK1
SCHEMBL4748631 0.76 KMT2A (0.41) KMT2AHSD11B1ALDH1A1HPGDMAPK1
SCHEMBL2670372 0.69 ALDH1A1 (0.41) KMT2AHSD11B1ALDH1A1HPGDMAPK1
SCHEMBL4748628 0.69 SMYD2 (0.40) KMT2AHSD11B1

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-20120108582-A1 Fused substituted aminopyrrolidine derivative DAIICHI SANKYO COMPANY, LIMITED 2012-05-03 US disclosed
WO-2008082009-A2 FUSED SUBSTITUTED AMINOPYRROLIDINE DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2008-07-10 WO 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-20120108582-A1 Fused substituted aminopyrrolidine derivative NQO2, QDPR, IL4I1 KMT2A 2847/4885HSD11B1 3535/4885ALDH1A1 2730/4885

“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.