SCHEMBL13355486

SCHEMBL13355486

COCCCNC(=O)NS(=O)(=O)c1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.64
TDP1 Q9NUW8 2/20 0.59
POLB P06746 1/20 0.59
FBP1 P09467 13/20 0.57
ALDH1A1 P00352 1/20 0.55
LMNA P02545 1/20 0.55
ALB P02768 1/20 0.55
CYP2C9 P11712 1/20 0.55
TSHR P16473 1/20 0.55
MAPT P10636 1/20 0.54
PKM P14618 1/20 0.54
SMN1; SMN2 Q16637 1/20 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
SCHEMBL13323595 0.85 ALDH1A1 (0.58) TDP1FBP1ALDH1A1LMNAALB
SCHEMBL5931108 0.85 FBP1 (0.70) TDP1FBP1ALDH1A1LMNAALB
SCHEMBL184964 0.84 CYP2C9 (0.76) TDP1FBP1ALDH1A1LMNAALB
Methyl Alcohol SCHEMBL28260710 0.82 CYP2C9 (0.74) TDP1FBP1ALDH1A1LMNAALB
SCHEMBL11049679 0.82 CYP2C9 (0.69) TDP1FBP1ALDH1A1LMNAALB
SCHEMBL4923123 0.82 LMNA (0.61) TDP1FBP1ALDH1A1LMNAALB
SCHEMBL19271872 0.81 EPHX2 (0.68) TDP1FBP1ALDH1A1LMNAALB
SCHEMBL28534045 0.81 EPHX2 (0.68) TDP1FBP1ALDH1A1LMNAALB
SCHEMBL2290886 0.80 ALDH1A1 (0.72) TDP1FBP1ALDH1A1LMNAALB
SCHEMBL11043925 0.80 FBP1 (0.57) TDP1FBP1ALDH1A1LMNAALB

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-8343968-B2 Case of renin inhibitors MERCK CANADA INC. (CA) 2013-01-01 US disclosed
US-20100120859-A1 NOVEL CASE OF RENIN INHIBITORS MERCK FROSST CANADA LTD. (CA) 2010-05-13 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-20100120859-A1 NOVEL CASE OF RENIN INHIBITORS REN, ACE, AGTR1 MAPK1 1667/4885TDP1 4334/4885POLB 1941/4885

“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.