SCHEMBL8224696

SCHEMBL8224696

CS(=O)(=O)CCn1ccc2c(N=O)cccc2c1=O

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.42
GRM2 Q14416 17/20 0.42
MAPT P10636 1/20 0.35
TP53 P04637 1/20 0.35
POLB P06746 1/20 0.35

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
SCHEMBL3753520 0.82 PARP1 (0.62) PARP1GRM2
SCHEMBL13079283 0.80 GRM2 (0.46) PARP1GRM2
SCHEMBL3741562 0.76 GAA (0.60) PARP1GRM2MAPTTP53POLB
SCHEMBL8224004 0.75 MAPK1 (0.47) PARP1GRM2MAPTTP53POLB
SCHEMBL17571986 0.75 ALDH1A1 (0.43) PARP1GRM2MAPTTP53POLB
SCHEMBL13078853 0.75 GAA (0.53) GRM2MAPTTP53POLB
SCHEMBL13774307 0.73 DHPS (0.54) PARP1GRM2MAPTPOLB
SCHEMBL13266828 0.72 KDM4E (0.52) PARP1MAPTTP53
SCHEMBL13078856 0.68 KDM4E (0.52) GRM2
SCHEMBL7469699 0.68 ALDH1A1 (0.35) GRM2MAPT

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-20100292235-A1 Bicycloheteroaryl Compounds as P2x7 Modulators and Uses Thereof SECOND GENOME, INC. 2010-11-18 US disclosed
WO-2007109172-A2 BICYCLOHETEROARYL COMPOUNDS AS P2X7 MODULATORS AND USES THEREOF RENOVIS, INC. (US) 2007-09-27 WO 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-20100292235-A1 Bicycloheteroaryl Compounds as P2x7 Modulators and Uses Thereof P2RX7, P2RX3, P2RX2 PARP1 1754/4885GRM2 332/4885MAPT 4477/4885

“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.