SCHEMBL6730613

SCHEMBL6730613

CCS(=O)(=O)Nc1ccc(Oc2ccc(F)cc2F)cc1

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 18/20 0.54
EP300 Q09472 2/20 0.50
BRD2 P25440 1/20 0.50
ADORA2B P29275 1/20 0.50
TSPO P30536 1/20 0.50
BRD3 Q15059 1/20 0.50
BRDT Q58F21 1/20 0.50
MAPK14 Q16539 1/20 0.49
HSPB1 P04792 1/20 0.49

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
SCHEMBL6735879 0.85 BRD4 (0.51) BRD4HSPB1
SCHEMBL16651036 0.84 BRD4 (0.48) BRD4EP300BRD2ADORA2BTSPO
SCHEMBL16660689 0.84 BRD4 (0.59) BRD4EP300BRD2ADORA2BTSPO
SCHEMBL16868381 0.84 BRD4 (0.58) BRD4EP300BRD2ADORA2BTSPO
SCHEMBL20159992 0.83 BRD4 (0.57) BRD4EP300BRD2ADORA2BTSPO
SCHEMBL16333294 0.83 BRD4 (0.57) BRD4EP300BRD2ADORA2BTSPO
SCHEMBL28880313 0.81 BRD4 (0.50) BRD4EP300BRD2ADORA2BTSPO
SCHEMBL16658392 0.81 BRD4 (0.55) BRD4EP300BRD2ADORA2BTSPO
SCHEMBL16651491 0.81 BRD4 (0.55) BRD4EP300BRD2ADORA2BTSPO
SCHEMBL20160100 0.77 BRD4 (0.60) BRD4EP300BRD2ADORA2BTSPO

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110041253-B Pyridine N-oxide derivative and preparation method and application thereof 上海翰森生物医药科技有限公司 2022-03-29 CN disclosed
CN-109836385-B Tetrahydroquinoline N-oxide derivative and preparation method and application thereof 上海翰森生物医药科技有限公司 2021-12-17 CN disclosed
CN-110198941-B Pyrrolopyridine N-oxide derivative and preparation method and application thereof 江苏豪森药业集团有限公司 2021-09-28 CN disclosed
US-6800651-B2 Potentiators of glutamate receptors ELI LILLY AND COMPANY 2004-10-05 US disclosed
US-20040006114-A1 Potentiators of glutamate receptors ELI LILLY AND COMPANY 2004-01-08 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-20040006114-A1 Potentiators of glutamate receptors GRM1, GRIN1, GRM2 BRD4 3241/4885EP300 1615/4885BRD2 3212/4885

“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.