SCHEMBL29911511

SCHEMBL29911511

O=C(O)c1ccccc1/C=N/Nc1nc(-c2cc(Cl)ccc2Cl)cs1

nearest known ligand 0.81

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ DHODH Q02127 12/20 0.81
▸ RORC P51449 1/20 0.54
▸ PKM P14618 1/20 0.51
▸ MAPT P10636 4/20 0.51
▸ POLB P06746 3/20 0.51
▸ KDM4E B2RXH2 2/20 0.50
▸ ALDH1A1 P00352 1/20 0.50
▸ GAA P10253 2/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ LMNA P02545 1/20 0.49
▸ XBP1 P17861 1/20 0.49
▸ KMT2A Q03164 1/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.49
▸ TDP1 Q9NUW8 1/20 0.49

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
SCHEMBL20956439 1.00 DHODH (0.81) DHODHRORCPKMMAPTPOLB
SCHEMBL19631412 1.00 DHODH (0.81) DHODHRORCPKMMAPTPOLB
SCHEMBL20956565 0.90 DHODH (1.00) DHODHMAPTPOLBKDM4EALDH1A1
SCHEMBL19631365 0.90 DHODH (1.00) DHODHMAPTPOLBKDM4EALDH1A1
SCHEMBL29911563 0.90 DHODH (1.00) DHODHMAPTPOLBKDM4EALDH1A1
SCHEMBL25614473 0.89 DHODH (0.69) DHODHRORCPKMMAPTPOLB
SCHEMBL20956442 0.82 DHODH (1.00) DHODHMAPTKDM4EALDH1A1GAA
SCHEMBL29911504 0.82 DHODH (1.00) DHODHMAPTKDM4EALDH1A1GAA
SCHEMBL19631441 0.82 DHODH (1.00) DHODHMAPTKDM4EALDH1A1GAA
SCHEMBL19631360 0.80 DHODH (0.78) DHODHMAPTPOLBKDM4EALDH1A1

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-107375279-B Use of novel thiazole derivatives for the treatment of inflammatory bowel disease 华东理工大学 2022-11-01 — — CN disclosed
CN-107459496-B Use of thiazole derivatives for treating viral infections 华东理工大学 2022-07-19 — — CN disclosed
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