SCHEMBL7702504

SCHEMBL7702504

COc1ccc2c(c1)C(NN)=NCc1c(-c3nc(C4CC4)no3)ncn1-2

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GABRG2 P18507 3/20 0.39
GABRB3 P28472 3/20 0.39
GABRA5 P31644 1/20 0.39
GABRA3 P34903 2/20 0.38
MTNR1A P48039 1/20 0.37
MTNR1B P49286 1/20 0.37

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
SCHEMBL7708380 0.86 GABRG2 (0.38) GABRG2GABRB3GABRA3
SCHEMBL6862438 0.79 GABRG2 (0.37) GABRG2GABRB3GABRA5GABRA3MTNR1A
SCHEMBL6867159 0.78 GABRG2 (0.54) GABRG2GABRB3GABRA5
SCHEMBL6866884 0.78 GABRG2 (0.53) GABRG2GABRB3GABRA5
SCHEMBL26083962 0.77 GABRG2 (0.37) GABRG2GABRB3GABRA5MTNR1AMTNR1B
SCHEMBL26084236 0.76 GABRG2 (0.36) GABRG2GABRB3GABRA5MTNR1AMTNR1B
SCHEMBL6873729 0.75 GABRG2 (0.47) GABRG2GABRB3GABRA5
SCHEMBL6871583 0.74 GABRG2 (0.45) GABRG2GABRB3GABRA5
SCHEMBL26084239 0.74 GABRG2 (0.38) GABRG2GABRB3GABRA5MTNR1AMTNR1B
SCHEMBL16840818 0.74 GABRG2 (0.45) GABRG2GABRB3GABRA5MTNR1AMTNR1B

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-20020103371-A1 Substituted imidazo [1,5-a] [1,2,4] triazolo [4,3-d] [1,4] benzodiazepine derivatives HOFFMANN-LA ROCHE INC. 2002-08-01 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-20020103371-A1 Substituted imidazo [1,5-a] [1,2,4] triazolo [4,3-d] [1,4] benzodiazepine derivatives GABRA5, GABRA1, GABRA4 GABRG2 15/4885GABRB3 11/4885GABRA5 1/4885

“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.