SCHEMBL2805873

SCHEMBL2805873

CCCCOCCCC(=O)Nc1ccc2nc(-c3ccc(Oc4ccccc4)cc3)[nH]c2c1

nearest known ligand 0.60

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CHEK2 O96017 2/20 0.55
MMP2 P08253 2/20 0.54
MMP9 P14780 2/20 0.54
MMP8 P22894 2/20 0.54
MMP13 P45452 2/20 0.54

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
SCHEMBL2802971 0.86 MMP2 (0.73) CHEK2MMP2MMP9MMP8MMP13
SCHEMBL2805951 0.84 CHEK2 (0.57) CHEK2MMP2MMP9MMP8MMP13
SCHEMBL2804495 0.83 CHEK2 (0.56) CHEK2MMP2MMP9MMP8MMP13
SCHEMBL2804762 0.81 MMP2 (0.63) CHEK2MMP2MMP9MMP8MMP13
SCHEMBL2313636 0.80 CHEK2 (0.55) CHEK2
SCHEMBL2802895 0.76 SCD (0.56) CHEK2
SCHEMBL2809774 0.76 KDR (0.57) CHEK2
SCHEMBL21018492 0.76 EGFR (0.65) MMP2MMP9MMP8MMP13
SCHEMBL2808586 0.75 MMP2 (0.62) CHEK2MMP2MMP9MMP8MMP13
SCHEMBL15702615 0.75 MMP2 (0.61) MMP2MMP9MMP8MMP13

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-20100240580-A1 AZOLOARINE DERIVATIVES, METHOD FOR THE PRODUCTION THEREOF, PHARMACEUTICALS CONTAINING THESE COMPOUNDS AND THE USE THEREOF SANOFI-AVENTIS (FR) 2010-09-23 US claimed
US-20100240580-A1 AZOLOARINE DERIVATIVES, METHOD FOR THE PRODUCTION THEREOF, PHARMACEUTICALS CONTAINING THESE COMPOUNDS AND THE USE THEREOF SANOFI-AVENTIS (FR) 2010-09-23 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-20100240580-A1 AZOLOARINE DERIVATIVES, METHOD FOR THE PRODUCTION THEREOF, PHARMACEUTICALS CONTAINING THESE COMPOUNDS AND THE USE THEREOF CYP3A43, CYP11B1, CYP11B2 CHEK2 3959/4885MMP2 3953/4885MMP9 2966/4885

“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.