SCHEMBL4909976

SCHEMBL4909976

CS(=O)(=O)OCc1ccccc1-c1cc2ccccc2s1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.42
CA1 P00915 2/20 0.42
CA9 Q16790 2/20 0.42
APP P05067 2/20 0.40
PTGS2 P35354 2/20 0.39
PTGS1 P23219 1/20 0.39
AGXT P21549 1/20 0.37
HSD17B1 P14061 1/20 0.37
HSD17B2 P37059 1/20 0.37
BRD4 O60885 1/20 0.37
CREBBP Q92793 1/20 0.37
TNIK Q9UKE5 1/20 0.36
CKS1B P61024 1/20 0.35
SKP2 Q13309 1/20 0.35
SLC16A3 O15427 1/20 0.35
SLC16A1 P53985 1/20 0.35
SLC9A1 P19634 1/20 0.35
ERN1 O75460 2/20 0.35
CA12 O43570 1/20 0.34
PIK3R1 P27986 1/20 0.34

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
SCHEMBL4909971 0.78 CA2 (0.55) CA2CA1CA9APPPTGS2
SCHEMBL14106986 0.77 AGXT (0.58) CA2PTGS2AGXTSLC9A1
SCHEMBL4901013 0.75 KDM4E (0.51)
SCHEMBL477484 0.73 CYP2A6 (0.53) CA2CA1CA9APPAGXT
SCHEMBL4909643 0.73 APP (0.45) CA2CA1CA9APPAGXT
SCHEMBL19133572 0.72 APP (0.57) CA2CA1CA9APPAGXT
SCHEMBL5273095 0.72 CYP1A2 (0.41) CA2CA1CA9CA12
SCHEMBL4049432 0.71 BCL2L1 (0.46) CA2CA1CA9APPHSD17B1
SCHEMBL2208502 0.70 APP (0.40) CA2CA1CA9APPPTGS2
SCHEMBL12854022 0.70 APP (0.55) CA2CA1CA9APPAGXT

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080299041-A1 HETEROCYCLIC INDENE DERIVATIVES AND THEIR RADIOISOTOPE LABELED COMPOUNDS FOR IMAGING BETA-AMYLOID DEPOSITION SEOUL NATIONAL UNIVERSITY INDUSTRY FOUNDATION (KR) 2008-12-04 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-20080299041-A1 HETEROCYCLIC INDENE DERIVATIVES AND THEIR RADIOISOTOPE LABELED COMPOUNDS FOR IMAGING BETA-AMYLOID DEPOSITION APP, BACE1, PSEN1 CA2 3781/4885CA1 1482/4885CA9 2652/4885

“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.