SCHEMBL13587404

SCHEMBL13587404

CC12CC3CC(C)(C1)CC(CC(=O)Nc1cccc4c(=O)n(-c5cccnc5)ccc14)(C3)C2

nearest known ligand 0.49

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 16/20 0.49
POLB P06746 1/20 0.44
MEN1 O00255 1/20 0.42
USP2 O75604 1/20 0.42
KMT2A Q03164 1/20 0.42
SHMT2 P34897 1/20 0.37
P2RX3 P56373 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
SCHEMBL4157438 0.87 P2RX7 (0.49) P2RX7POLBMEN1USP2KMT2A
SCHEMBL4147936 0.82 P2RX7 (0.51) P2RX7POLB
SCHEMBL13243884 0.80 P2RX7 (0.54) P2RX7
SCHEMBL4154127 0.79 P2RX7 (0.76) P2RX7KMT2A
SCHEMBL4132630 0.79 P2RX7 (0.53) P2RX7POLBMEN1KMT2A
SCHEMBL4147036 0.79 P2RX7 (0.49) P2RX7POLBKMT2ASHMT2
SCHEMBL4145612 0.78 P2RX7 (0.49) P2RX7POLBKMT2A
SCHEMBL13587418 0.78 P2RX7 (0.60) P2RX7MEN1USP2KMT2A
SCHEMBL4142159 0.78 P2RX7 (0.52) P2RX7POLB
SCHEMBL13243898 0.78 P2RX7 (0.62) P2RX7KMT2A

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-20090298825-A1 Bicycloheteroaryl Compounds as P2x7 Modulators and Uses Thereof RENOVIS, INC. 2009-12-03 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-20090298825-A1 Bicycloheteroaryl Compounds as P2x7 Modulators and Uses Thereof P2RX7, P2RX3, P2RX1 P2RX7 1/4885POLB 3609/4885MEN1 4837/4885

“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.