SCHEMBL23302010

SCHEMBL23302010

COc1ncc(C)c(Br)c1Cl

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RORC P51449 1/20 0.33
TSHR P16473 2/20 0.32
CCR4 P51679 5/20 0.31
ALDH1A1 P00352 1/20 0.31
KCNJ5 P48544 1/20 0.31
KCNJ3 P48549 1/20 0.31
AXL P30530 1/20 0.31
PRKCI P41743 1/20 0.31
HTT P42858 1/20 0.30
RECQL P46063 1/20 0.30

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
SCHEMBL29755706 1.00 RORC (0.33) RORCTSHRCCR4ALDH1A1KCNJ5
SCHEMBL9275751 0.79 AGXT (0.34) TSHRHTTRECQL
SCHEMBL29755825 0.79 AGXT (0.34) TSHRHTTRECQL
SCHEMBL22564749 0.79 CCR1 (0.35) RORCTSHRCCR4KCNJ5KCNJ3
SCHEMBL27916480 0.78 AGXT (0.41) RORCCCR4ALDH1A1KCNJ5KCNJ3
SCHEMBL22224634 0.76 HTT (0.37) RORCHTTRECQL
SCHEMBL23723621 0.76 KCNJ5 (0.33) RORCCCR4KCNJ5KCNJ3AXL
SCHEMBL22570334 0.73 CD274 (0.33) RORCCCR4
SCHEMBL22340093 0.73 RORC (0.34) RORCCCR4AXLPRKCI
SCHEMBL22570339 0.73 RORC (0.34) RORCCCR4KCNJ5KCNJ3

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-20230037448-A1 FLUORINATED QUINOLINE AND QUINOXALINE DERIVATIVES AS DIHYDROOROTATE DEHYDROGENASE (DHODH) INHIBITORS FOR THE TREATMENT OF CANCER, AUTOIMMUNE AND INFLAMMATORY DISEASES NOVIRA THERAPEUTICS, LLC 2023-02-09 US disclosed
EP-4051672-A1 FLUORINATED QUINOLINE AND QUINOXALINE DERIVATIVES AS DIHYDROOROTATE DEHYDROGENASE (DHODH) INHIBITORS FOR THE TREATMENT OF CANCER, AUTOIMMUNE AND INFLAMMATORY DISEASES Janssen Biotech, Inc. (US) 2022-09-07 EP disclosed
CN-114650988-A Fluorinated quinoline and quinoxaline derivatives as inhibitors of dihydroorotate dehydrogenase (DHODH) for the treatment of cancer, autoimmune and inflammatory diseases 詹森生物科技公司 2022-06-21 CN disclosed
WO-2021084500-A1 FLUORINATED QUINOLINE AND QUINOXALINE DERIVATIVES AS DIHYDROOROTATE DEHYDROGENASE (DHODH) INHIBITORS FOR THE TREATMENT OF CANCER, AUTOIMMUNE AND INFLAMMATORY DISEASES JANSSEN BIOTECH, INC. (US) 2021-05-06 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-20230037448-A1 FLUORINATED QUINOLINE AND QUINOXALINE DERIVATIVES AS DIHYDROOROTATE DEHYDROGENASE (DHODH) INHIBITORS FOR THE TREATMENT OF CANCER, AUTOIMMUNE AND INFLAMMATORY DISEASES DHODH, NQO2, DPYD RORC 939/4885TSHR 2863/4885CCR4 2823/4885

“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.