SCHEMBL22552272

SCHEMBL22552272

COc1nccc(C)c1-n1cc(C(C)C)c2ccccc2c1=O

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 13/20 0.52
ATP4A P20648 2/20 0.40
ATP4B P51164 2/20 0.40
BRD9 Q9H8M2 1/20 0.34
BRD7 Q9NPI1 1/20 0.34
BRD4 O60885 2/20 0.33
GRM1 Q13255 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
SCHEMBL22552387 0.83 DHODH (0.53) DHODHATP4AATP4BBRD9BRD7
SCHEMBL22552485 0.82 DHODH (0.51) DHODHATP4AATP4BBRD9BRD7
SCHEMBL22552452 0.81 DHODH (0.53) DHODHATP4AATP4BBRD9BRD7
SCHEMBL22552479 0.79 DHODH (0.54) DHODH
SCHEMBL22552471 0.74 DHODH (0.50) DHODHATP4AATP4BBRD4
SCHEMBL22552310 0.74 DHODH (0.52) DHODHATP4AATP4BBRD4
SCHEMBL22552427 0.73 DHODH (0.50) DHODHATP4AATP4B
SCHEMBL22552536 0.72 DHODH (0.39) DHODHATP4AATP4BBRD4
SCHEMBL22552176 0.72 DHODH (0.52) DHODHATP4AATP4BBRD4
SCHEMBL22552455 0.71 DHODH (0.53) DHODHATP4AATP4BBRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11753393-B2 Dihydroorotate dehydrogenase inhibitors JANSSEN BIOTECH, INC. 2023-09-12 US disclosed
US-11505536-B2 Dihydroorotate dehydrogenase inhibitors JANSSEN BIOTECH, INC. 2022-11-22 US disclosed
US-20220298137-A1 DIHYDROOROTATE DEHYDROGENASE INHIBITORS JANSSEN BIOTECH INC (US) 2022-09-22 US disclosed
US-20200331881-A1 DIHYDROOROTATE DEHYDROGENASE INHIBITORS JANSSEN BIOTECH, INC. 2020-10-22 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 (4 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-11753393-B2 Dihydroorotate dehydrogenase inhibitors DHODH, DLD, DPYD DHODH 1/4885ATP4A 1124/4885ATP4B 1949/4885
US-11505536-B2 Dihydroorotate dehydrogenase inhibitors DHODH, DLD, DPYD DHODH 1/4885ATP4A 1124/4885ATP4B 1949/4885
US-20220298137-A1 DIHYDROOROTATE DEHYDROGENASE INHIBITORS DHODH, DLD, DPYD DHODH 1/4885ATP4A 1124/4885ATP4B 1949/4885
US-20200331881-A1 DIHYDROOROTATE DEHYDROGENASE INHIBITORS DHODH, DLD, DPYD DHODH 1/4885ATP4A 1124/4885ATP4B 1949/4885

“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.