SCHEMBL21787283

SCHEMBL21787283

COC(=O)c1cn(Cc2ccc(-c3ccccc3)cc2)c2c(OC)c(F)c(F)cc2c1=O

nearest known ligand 0.67

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TOP1 P11387 14/20 0.67
CHRM1 P11229 4/20 0.54
SMN1; SMN2 Q16637 1/20 0.46
MAPT P10636 1/20 0.46

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
SCHEMBL21787284 0.92 TOP1 (0.68) TOP1CHRM1
SCHEMBL20258341 0.88 TOP1 (0.57) TOP1CHRM1SMN1; SMN2MAPT
SCHEMBL20258384 0.82 TOP1 (0.60) TOP1CHRM1SMN1; SMN2MAPT
SCHEMBL20258389 0.81 TOP1 (0.66) TOP1CHRM1SMN1; SMN2MAPT
SCHEMBL3869129 0.81 TOP1 (0.45) TOP1
SCHEMBL20258342 0.81 TOP1 (0.67) TOP1CHRM1SMN1; SMN2
SCHEMBL20258390 0.81 TOP1 (1.00) TOP1
SCHEMBL20258352 0.80 TOP1 (0.67) TOP1CHRM1
SCHEMBL12586303 0.79 TOP1 (0.44) TOP1SMN1; SMN2
SCHEMBL20258354 0.79 TOP1 (0.62) TOP1CHRM1

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-10981875-B2 Quinolone-based compounds with anticancer activity REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 2021-04-20 US disclosed
US-20200071273-A1 QUINOLONE-BASED COMPOUNDS WITH ANTICANCER ACTIVITY UNIVERSITY OF IOWA RESEARCH FOUNDATION 2020-03-05 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 (2 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-20200071273-A1 QUINOLONE-BASED COMPOUNDS WITH ANTICANCER ACTIVITY TOP2A, TOP2B, TOP1 TOP1 3/4885CHRM1 4607/4885SMN1; SMN2 3800/4885
US-10981875-B2 Quinolone-based compounds with anticancer activity TOP2A, TOP2B, TOP1 TOP1 3/4885CHRM1 4607/4885SMN1; SMN2 3800/4885

“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.