SCHEMBL28654546

SCHEMBL28654546

Cc1ccc(/C=N/Nc2nc(-c3cc(Cl)cc(Cl)c3)cs2)c(C(=O)NS(C)(=O)=O)c1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ DHODH Q02127 5/20 0.47
▸ GUSB P08236 4/20 0.45
▸ MAPT P10636 3/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ KMT2A Q03164 1/20 0.44
▸ PTGS2 P35354 3/20 0.43
▸ EGFR P00533 1/20 0.43
▸ KDM4E B2RXH2 2/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ POLB P06746 1/20 0.42
▸ GAA P10253 2/20 0.41
▸ MGAM O43451 1/20 0.41
▸ SI P14410 1/20 0.41
▸ MGAM2 Q2M2H8 1/20 0.41

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
SCHEMBL28654548 1.00 DHODH (0.47) DHODHGUSBMAPTMEN1KMT2A
SCHEMBL28673044 0.86 DHODH (0.64) DHODHGUSBMAPTMEN1KMT2A
SCHEMBL28673047 0.86 DHODH (0.64) DHODHGUSBMAPTMEN1KMT2A
SCHEMBL19631360 0.72 DHODH (0.78) DHODHMAPTKDM4EALDH1A1POLB
SCHEMBL20956437 0.69 DHODH (0.85) DHODHGUSBMAPTMEN1KMT2A
SCHEMBL19631410 0.69 DHODH (0.85) DHODHGUSBMAPTMEN1KMT2A
SCHEMBL25614522 0.69 DHODH (0.58) DHODHGUSBMAPTMEN1KMT2A
SCHEMBL25614468 0.68 DHODH (0.68) DHODHGUSBMAPTMEN1KMT2A
SCHEMBL14567100 0.66 PTGS2 (0.63) GUSBMAPTMEN1KMT2APTGS2
SCHEMBL15953063 0.66 GUSB (0.60) DHODHGUSBMAPTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113773275-B Antiviral compound and preparation method thereof 广东中科药物研究有限公司 2023-04-25 — — CN disclosed
CN-113773275-A Antiviral compound and preparation method thereof 广东中科药物研究有限公司 2021-12-10 — — CN disclosed
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