SCHEMBL3198675

SCHEMBL3198675

Cc1sc2c(c1C)C(c1ccc(-c3cccc(CO)c3)cc1)=N[C@@H](CC(=O)O)c1nnc(C)n1-2

nearest known ligand 0.72

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 20/20 0.72
BRD2 P25440 4/20 0.62
DNER Q8NFT8 1/20 0.61
ADORA3 P0DMS8 1/20 0.59
TSPO P30536 1/20 0.59
BRDT Q58F21 2/20 0.58
BRD3 Q15059 1/20 0.57

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
SCHEMBL3197736 0.91 BRD4 (0.79) BRD4BRD2DNERADORA3TSPO
SCHEMBL3196802 0.91 BRD4 (0.69) BRD4BRD2DNERADORA3TSPO
SCHEMBL3191198 0.90 BRD4 (0.67) BRD4BRD2DNERADORA3TSPO
SCHEMBL3207232 0.89 BRD4 (0.73) BRD4BRD2DNERADORA3TSPO
SCHEMBL25092048 0.88 BRD4 (0.83) BRD4BRD2DNERADORA3TSPO
SCHEMBL18484183 0.88 BRD4 (0.83) BRD4BRD2DNERADORA3TSPO
SCHEMBL3191122 0.88 BRD4 (0.72) BRD4BRD2DNERADORA3TSPO
SCHEMBL3205049 0.88 BRD4 (0.72) BRD4BRD2DNERADORA3TSPO
SCHEMBL3197611 0.87 BRD4 (0.71) BRD4BRD2DNERADORA3TSPO
SCHEMBL3214253 0.87 BRD4 (0.71) BRD4BRD2DNERADORA3TSPO

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
EP-1887008-B1 THIENOTRIAZOLODIAZEPINE COMPOUND AND A MEDICINAL USE THEREOF MITSUBISHI TANABE PHARMA CORP (JP) 2021-04-21 EP disclosed
US-20100041643-A1 THIENOTRIAZOLODIAZEPINE COMPOUND AND MEDICINAL USE THEREOF MITSUBISHI TANABE PHARMA CORPORATION (JP) 2010-02-18 US disclosed
EP-1887008-A1 THIENOTRIAZOLODIAZEPINE COMPOUND AND A MEDICINAL USE THEREOF Mitsubishi Tanabe Pharma Corporation (JP) 2008-02-13 EP 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-20100041643-A1 THIENOTRIAZOLODIAZEPINE COMPOUND AND MEDICINAL USE THEREOF ICOS, CD4, CD2 BRD4 265/4885BRD2 318/4885DNER 3109/4885

“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.