SCHEMBL1762234

SCHEMBL1762234

N=C(NO)c1ccc2c(c1)ncn2-c1cccc(-c2ccccc2Cl)c1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.47
FGFR1 P11362 6/20 0.46
GABRA1 P14867 2/20 0.45
GABRG2 P18507 2/20 0.45
GABRB3 P28472 2/20 0.45
GABRA5 P31644 2/20 0.45
GABRA3 P34903 2/20 0.45
HPGD P15428 10/20 0.44
ALDH1A1 P00352 1/20 0.44
GABRA2 P47869 1/20 0.42

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
SCHEMBL1761987 0.92 TP53 (0.44) TP53FGFR1GABRA1GABRG2GABRB3
SCHEMBL1761930 0.90 TP53 (0.47) TP53FGFR1GABRA1GABRG2GABRB3
SCHEMBL1761875 0.88 GABRA1 (0.48) TP53FGFR1GABRA1GABRG2GABRB3
SCHEMBL1761946 0.88 GABRA1 (0.46) TP53FGFR1GABRA1GABRG2GABRB3
SCHEMBL1762114 0.88 GABRA1 (0.47) TP53FGFR1GABRA1GABRG2GABRB3
SCHEMBL1762285 0.85 HPGD (0.48) TP53FGFR1GABRA1GABRG2GABRB3
SCHEMBL1761689 0.84 FGFR1 (0.54) TP53FGFR1GABRA1GABRG2GABRB3
SCHEMBL1761957 0.84 GABRA1 (0.43) TP53FGFR1GABRA1GABRG2GABRB3
SCHEMBL1761927 0.83 GABRA1 (0.47) TP53FGFR1GABRA1GABRG2GABRB3
SCHEMBL1762050 0.83 FGFR1 (0.45) TP53FGFR1GABRA1GABRG2GABRB3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110118259-A1 BENZIMIDAZOLE DERIVATIVES AND THEIR USE FOR MODULATING THE GABAA RECEPTOR COMPLEX SANIONA A/S (DK) 2011-05-19 US claimed
EP-2319837-A1 Benzimidazole derivatives and their use for modulating the GABAa receptor complex NeuroSearch AS (DK) 2011-05-11 EP claimed
US-20090036476-A1 BENZIMIDAZOLE DERIVATIVES AND THEIR USE FOR MODULATING THE GABAA RECEPTOR COMPLEX SANIONA A/S (DK) 2009-02-05 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 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-20090036476-A1 BENZIMIDAZOLE DERIVATIVES AND THEIR USE FOR MODULATING THE GABAA RECEPTOR COMPLEX GABRB2, GABRB1, GABRB3 TP53 4874/4885FGFR1 3907/4885GABRA1 6/4885
US-20110118259-A1 BENZIMIDAZOLE DERIVATIVES AND THEIR USE FOR MODULATING THE GABAA RECEPTOR COMPLEX GABRB2, GABRB1, GABRB3 TP53 4874/4885FGFR1 3907/4885GABRA1 6/4885

“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.