SCHEMBL6481640

SCHEMBL6481640

CCOC(=O)c1cc(C2CC2)c2c(C)c(N3C[C@@H](CC)C[C@H](NC(=O)OC(C)(C)C)C3)c([N+](=O)[O-])cn2c1=O

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 1/20 0.33
MAPT P10636 4/20 0.32
ALDH1A1 P00352 2/20 0.32
LMNA P02545 1/20 0.32
DRD2 P14416 1/20 0.32
KDM4E B2RXH2 2/20 0.31
POLB P06746 2/20 0.31
MEN1 O00255 1/20 0.31
THRB P10828 1/20 0.31
KMT2A Q03164 1/20 0.31
RECQL P46063 1/20 0.31
RET P07949 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
SCHEMBL6486743 0.89 KAT8 (0.32) DRD2RET
SCHEMBL6170568 0.89 RET (0.31) RET
SCHEMBL6480041 0.82 KAT8 (0.32) KMT2ARET
SCHEMBL6169447 0.81 EIF2AK4 (0.35) MEN1KMT2ARET
SCHEMBL6169430 0.81 EIF2AK4 (0.35) DPP4MEN1KMT2ARET
SCHEMBL7509631 0.78 PIM1 (0.35) DPP4RET
SCHEMBL6169186 0.74 POLB (0.45) MAPTALDH1A1LMNAKDM4EPOLB
SCHEMBL6803943 0.73 RET (0.32) RET
SCHEMBL7099200 0.73 RET (0.32) RET
SCHEMBL6803945 0.73 RET (0.32) RET

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-6900224-B2 Antimicrobial quinolones, their compositions and uses THE PROCTER & GAMBLE COMPANY (US) 2005-05-31 US disclosed
US-20040038975-A1 Antimicrobial quinolones, their compositions and uses THE PROCTER & GAMBLE COMPANY 2004-02-26 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-20040038975-A1 Antimicrobial quinolones, their compositions and uses QARS1, NQO2, Q6ZSR9 DPP4 621/4885MAPT 3831/4885ALDH1A1 2739/4885

“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.