SCHEMBL27037101

SCHEMBL27037101

CCn1ccc2cc[nH]c2c1=O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CECR2 Q9BXF3 3/20 0.61
BRD4 O60885 3/20 0.61
BRD9 Q9H8M2 2/20 0.61
TAF1 P21675 1/20 0.61
BRPF1 P55201 1/20 0.61
CREBBP Q92793 1/20 0.61
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPK1 P28482 1/20 0.36
BCHE P06276 1/20 0.33
CDK4 P11802 1/20 0.33
CCND1 P24385 1/20 0.33
NR3C1 P04150 1/20 0.33
PGR P06401 1/20 0.33
NR3C2 P08235 1/20 0.33
AR P10275 1/20 0.33
KEAP1 Q14145 1/20 0.33
AHR P35869 1/20 0.32
PPARG P37231 1/20 0.32
PPARD Q03181 1/20 0.32

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
SCHEMBL29482204 0.83 BRD9 (0.58) CECR2BRD4BRD9TAF1BRPF1
SCHEMBL27037081 0.79 BRD4 (0.57) CECR2BRD4BRD9TAF1BRPF1
SCHEMBL15066767 0.76 BRD4 (1.00) CECR2BRD4BRD9TAF1BRPF1
SCHEMBL21615134 0.71 BRD4 (0.61) CECR2BRD4BRD9TAF1BRPF1
SCHEMBL28695187 0.70 BRD4 (0.86) CECR2BRD4BRD9TAF1BRPF1
SCHEMBL10628118 0.67 BRD4 (0.34) BRD4KDM4EALDH1A1MAPK1
SCHEMBL29809320 0.67 TNF (0.55) BRD4KDM4EALDH1A1MAPK1
SCHEMBL179072 0.67 TNF (0.55) BRD4KDM4EALDH1A1MAPK1
SCHEMBL17913769 0.67 BRD9 (0.54) CECR2BRD4BRD9TAF1BRPF1
SCHEMBL20546492 0.66 MCL1 (0.39) KDM4EALDH1A1MAPK1

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
US-20250296931-A1 NOVEL ISOQUINOLINONE, PYRROLOPYRIDINONE AND THIENOPYRIDINONE SULFONAMIDE DERIVATIVES HOFFMANN-LA ROCHE INC. (US) 2025-09-25 US disclosed
EP-4558483-A1 NOVEL ISOQUINOLINONE, PYRROLOPYRIDINONE AND THIENOPYRIDINONE SULFONAMIDE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2025-05-28 EP disclosed
CN-119546576-A Novel isoquinolinones pyrrolo-pyridones and thieno pyridone sulfonamide derivatives 豪夫迈·罗氏有限公司 2025-02-28 CN disclosed
WO-2024017856-A1 NOVEL ISOQUINOLINONE, PYRROLOPYRIDINONE AND THIENOPYRIDINONE SULFONAMIDE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2024-01-25 WO disclosed
WO-2024017856-A1 NOVEL ISOQUINOLINONE, PYRROLOPYRIDINONE AND THIENOPYRIDINONE SULFONAMIDE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2024-01-25 WO 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-20250296931-A1 NOVEL ISOQUINOLINONE, PYRROLOPYRIDINONE AND THIENOPYRIDINONE SULFONAMIDE DERIVATIVES SULT1E1, XDH, PRXL2A CECR2 1316/4885BRD4 157/4885BRD9 1648/4885

“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.