SCHEMBL19657992

SCHEMBL19657992

CC(C)ONC(=O)OCc1ccc(N)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TPSAB1 Q15661 3/20 0.45
PRSS1 P07477 2/20 0.45
PLG P00747 1/20 0.45
F2 P00734 1/20 0.44
PLAU P00749 1/20 0.44
PLAT P00750 1/20 0.44
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA9 Q16790 1/20 0.42
ITGB1 P05556 2/20 0.40
ITGA5 P08648 2/20 0.40
ITGB3 P05106 1/20 0.40
ITGAV P06756 1/20 0.40
ALDH1A1 P00352 1/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
ATM Q13315 2/20 0.40
LMNA P02545 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL9104883 0.85 CA12 (0.58) CA12CA1CA2CA9ALDH1A1
SCHEMBL16772111 0.80 TOP2A (0.49) TPSAB1PRSS1PLGF2PLAU
SCHEMBL20434509 0.79 SCN1A (0.48) TPSAB1PRSS1PLGF2PLAU
SCHEMBL21671151 0.78 TPSAB1 (0.56) TPSAB1PRSS1PLGF2PLAU
SCHEMBL21671313 0.78 TPSAB1 (0.56) TPSAB1PRSS1PLGF2PLAU
SCHEMBL20467692 0.78 TPSAB1 (0.56) TPSAB1PRSS1PLGF2PLAU
SCHEMBL29026626 0.78 PPID (0.43) TPSAB1PRSS1PLGF2PLAU
SCHEMBL19037277 0.78 LMNA (0.43) TPSAB1PRSS1PLGF2PLAU
SCHEMBL22198338 0.77 TPSAB1 (0.48) TPSAB1PRSS1PLGF2PLAU
SCHEMBL25271685 0.76 PLAU (0.45) TPSAB1PRSS1PLGF2PLAU

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-10188746-B2 Pyrrolobenzodiazepines and conjugates thereof MEDIMMUNE LIMITED (GB) 2019-01-29 US disclosed
US-20170340752-A1 PYRROLOBENZODIAZEPINES AND CONJUGATES THEREOF MEDIMMUNE LIMITED (GB) 2017-11-30 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-10188746-B2 Pyrrolobenzodiazepines and conjugates thereof CD22, GABRA1, CCNB1 TPSAB1 190/4885PRSS1 3655/4885PLG 2820/4885
US-20170340752-A1 PYRROLOBENZODIAZEPINES AND CONJUGATES THEREOF CD22, GABRA1, CCNB1 TPSAB1 190/4885PRSS1 3655/4885PLG 2820/4885

“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.