SCHEMBL23214739

SCHEMBL23214739

CC(C)(C)OC(=O)N1CCCc2ccc(Br)nc21

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MPO P05164 1/20 0.41
ESR2 Q92731 1/20 0.39
FGFR4 P22455 8/20 0.39
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
NR1H2 P55055 1/20 0.38
BRD4 O60885 1/20 0.38
CYP11B2 P19099 1/20 0.37
UCHL1 P09936 1/20 0.36
KDM1A O60341 1/20 0.36
KDM4E B2RXH2 1/20 0.35
GBA1 P04062 2/20 0.35
GPR119 Q8TDV5 1/20 0.35

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
SCHEMBL30474547 0.86 MPO (0.41) MPOESR2FGFR4NPC1RAB9A
SCHEMBL6190206 0.86 MPO (0.41) MPOESR2FGFR4NPC1RAB9A
SCHEMBL30133442 0.85 ESR2 (0.41) MPOESR2FGFR4NPC1RAB9A
SCHEMBL12654612 0.85 ESR2 (0.41) MPOESR2FGFR4NPC1RAB9A
SCHEMBL30918952 0.84 MPO (0.41) MPOESR2FGFR4NPC1RAB9A
SCHEMBL17642774 0.82 MPO (0.41) MPOESR2FGFR4NPC1RAB9A
SCHEMBL30918981 0.82 MPO (0.41) MPOESR2FGFR4NPC1RAB9A
SCHEMBL30918953 0.82 FGFR4 (0.54) FGFR4
SCHEMBL31075955 0.82 GRM5 (0.39) MPOESR2FGFR4NPC1RAB9A
SCHEMBL12654377 0.82 MPO (0.41) MPOESR2FGFR4NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114630822-B Biaryl dihydroorotate acid dehydrogenase inhibitors 詹森生物科技公司 2024-10-01 CN disclosed
US-20240158414-A1 BI-ARYL DIHYDROOROTATE DEHYDROGENASE INHIBITORS JANSSEN BIOTECH, INC. 2024-05-16 US disclosed
EP-4041714-B1 BI-ARYL DIHYDROOROTATE DEHYDROGENASE INHIBITORS JANSSEN BIOTECH INC (US) 2023-12-13 EP disclosed
EP-4041714-A1 BI-ARYL DIHYDROOROTATE DEHYDROGENASE INHIBITORS Janssen Biotech, Inc. (US) 2022-08-17 EP disclosed
CN-114630822-A Biaryl dihydroorotate dehydrogenase inhibitors 詹森生物科技公司 2022-06-14 CN disclosed
WO-2021070132-A1 BI-ARYL DIHYDROOROTATE DEHYDROGENASE INHIBITORS JANSSEN BIOTECH, INC. (US) 2021-04-15 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-20240158414-A1 BI-ARYL DIHYDROOROTATE DEHYDROGENASE INHIBITORS DHODH, DLD, DPYD MPO 494/4885ESR2 2281/4885FGFR4 1900/4885

“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.