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Sugi Predict / Compounds / SCHEMBL20107903

SCHEMBL20107903

SCHEMBL20107903

CCCC(C)Oc1cc(-n2nc(CC)n(C)c2=O)c(F)cc1C(=O)Nc1c(F)cccc1F

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ DHODH Q02127 20/20 1.00

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
SCHEMBL29639570 1.00 DHODH (1.00) DHODH
SCHEMBL20107902 1.00 DHODH (1.00) DHODH
SCHEMBL29815458 0.95 DHODH (1.00) DHODH
SCHEMBL20107901 0.95 DHODH (1.00) DHODH
SCHEMBL20107891 0.95 DHODH (1.00) DHODH
SCHEMBL20107977 0.91 DHODH (1.00) DHODH
SCHEMBL20107975 0.91 DHODH (1.00) DHODH
SCHEMBL29639575 0.91 DHODH (1.00) DHODH
SCHEMBL22713098 0.90 DHODH (1.00) DHODH
SCHEMBL20108016 0.90 DHODH (1.00) DHODH

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
CN-115557907-A 2,4, 5-trisubstituted 1,2, 4-triazolones as DHODH inhibitors 拜耳股份有限公司 2023-01-03 — — CN disclosed
CN-110023302-B 2,4, 5-trisubstituted 1,2, 4-triazolones as DHODH inhibitors 拜耳股份有限公司 2022-07-26 — — CN disclosed
EP-3532468-B1 2,4,5-TRISUBSTITUTED 1,2,4-TRIAZOLONES USEFUL AS INHIBITORS OF DHODH BAYER AG (DE) 2022-03-23 — — EP disclosed
WO-2018077923-A1 2,4,5-TRISUBSTITUTED 1,2,4-TRIAZOLONES USEFUL AS INHIBITORS OF DHODH BAYER AKTIENGESELLSCHAFT (DE) 2018-05-03 — — WO disclosed