SCHEMBL5619012

SCHEMBL5619012

COc1ccccc1C(NC(=O)OC(C)(C)C)[C@H]1CCN([C@H](C)c2ccccc2)C1=O

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.39
CACNA1B Q00975 1/20 0.39
UTS2R Q9UKP6 3/20 0.39
DRD2 P14416 1/20 0.38
MAPK1 P28482 1/20 0.38
CTSK P43235 1/20 0.37

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
SCHEMBL5619552 0.85 KDM4D (0.44) KMT2A
SCHEMBL5618651 0.85 KMT2A (0.47) KMT2ACACNA1BUTS2RDRD2MAPK1
SCHEMBL5619497 0.83 KMT2A (0.39) KMT2AMAPK1CTSK
SCHEMBL5620010 0.83 KDM4D (0.40) CACNA1BUTS2RDRD2CTSK
SCHEMBL5619494 0.83 KMT2A (0.39) KMT2AMAPK1CTSK
SCHEMBL5619154 0.82 ADORA2B (0.39) KMT2AMAPK1CTSK
SCHEMBL5618387 0.80 CTSK (0.37) KMT2AMAPK1CTSK
SCHEMBL5618694 0.80 CTSK (0.37) KMT2AMAPK1CTSK
SCHEMBL4712368 0.74 KMT2A (0.53) KMT2AMAPK1CTSK
SCHEMBL4712370 0.74 KMT2A (0.53) KMT2AMAPK1CTSK

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-7186843-B2 potent antibacterial activity against various bacteria including drug-resistant strains DAIICHI PHARMACEUTICAL CO. LTD. (JP) 2007-03-06 US disclosed
US-20040209940-A1 Aminomethylpyrrolidine derivatives having aromatic substituents DAIICHI PHARMACEUTICAL CO., LTD. 2004-10-21 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-20040209940-A1 Aminomethylpyrrolidine derivatives having aromatic substituents Q6ZSR9, NAT1, NAT10 KMT2A 630/4885CACNA1B 985/4885UTS2R 2372/4885

“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.