SCHEMBL3415181

SCHEMBL3415181

CCc1nc(C(=O)O)c2n1-c1ccc(Br)cc1C(c1ccccn1)=NC2

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GABRA3 P34903 11/20 0.56
GABRA5 P31644 8/20 0.56
GABRA1 P14867 7/20 0.56
GABRA2 P47869 7/20 0.56
GABRB2 P47870 5/20 0.56
GABRG2 P18507 8/20 0.49
GABRB3 P28472 8/20 0.49
ADRA1A P35348 1/20 0.44
CYP1A2 P05177 1/20 0.43
TSHR P16473 1/20 0.38
RAB9A P51151 1/20 0.37
ATM Q13315 1/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
GABRA4 P48169 1/20 0.35
GABRA6 Q16445 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
SCHEMBL7308306 0.90 GABRA3 (0.62) GABRA3GABRA5GABRA1GABRA2GABRB2
SCHEMBL3417353 0.87 GABRA3 (0.67) GABRA3GABRA5GABRA1GABRA2GABRB2
SCHEMBL3417352 0.85 GABRA3 (0.53) GABRA3GABRA5GABRA1GABRA2GABRB2
SCHEMBL7312677 0.82 GABRA5 (0.57) GABRA3GABRA5GABRA1GABRA2GABRB2
SCHEMBL11629048 0.79 GABRG2 (0.74) GABRA3GABRA5GABRA1GABRA2GABRB2
SCHEMBL11705443 0.78 GABRA1 (0.76) GABRA3GABRA5GABRA1GABRA2GABRB2
SCHEMBL3415178 0.76 GABRG2 (0.77) GABRA3GABRA5GABRA1GABRA2GABRB2
SCHEMBL7311148 0.74 GABRA3 (0.70) GABRA3GABRA5GABRA1GABRA2GABRB2
SCHEMBL11709742 0.74 GABRA3 (0.66) GABRA3GABRA5GABRA1GABRA2GABRB2
SCHEMBL11035825 0.73 GABRA5 (0.41) GABRA3GABRA5GABRA1GABRA2GABRB2

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-20100261711-A1 SELECTIVE ANTICONVULSANT AGENTS AND THEIR USES WISYS TECHNOLOGY FOUNDATION (US) 2010-10-14 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-20100261711-A1 SELECTIVE ANTICONVULSANT AGENTS AND THEIR USES GABRA5, GABRA6, GABRA2 GABRA3 5/4885GABRA5 1/4885GABRA1 4/4885

“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.