SCHEMBL20842811

SCHEMBL20842811

O=COCOC(=O)c1ccccc1/C=N/Nc1nc(-c2ccccc2Cl)cs1

nearest known ligand 0.78

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ DHODH Q02127 16/20 0.78
▸ POLB P06746 2/20 0.55
▸ MAPT P10636 2/20 0.55
▸ ALDH1A1 P00352 2/20 0.55
▸ KDM4E B2RXH2 1/20 0.55
▸ GSTO1 P78417 1/20 0.45
▸ LMNA P02545 1/20 0.44

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
SCHEMBL30131181 0.88 DHODH (1.00) DHODHPOLBMAPTALDH1A1KDM4E
SCHEMBL19631366 0.88 DHODH (1.00) DHODHPOLBMAPTALDH1A1KDM4E
SCHEMBL19631444 0.87 DHODH (0.77) DHODHPOLBMAPTALDH1A1KDM4E
SCHEMBL30131122 0.86 DHODH (0.80) DHODHPOLBMAPTALDH1A1KDM4E
SCHEMBL19631490 0.86 DHODH (0.80) DHODHPOLBMAPTALDH1A1KDM4E
SCHEMBL19631451 0.86 DHODH (1.00) DHODHPOLBMAPTALDH1A1KDM4E
SCHEMBL30131171 0.86 DHODH (1.00) DHODHPOLBMAPTALDH1A1KDM4E
SCHEMBL19631459 0.86 DHODH (0.84) DHODHPOLBMAPTALDH1A1KDM4E
SCHEMBL19631419 0.85 DHODH (0.80) DHODHPOLBMAPTALDH1A1KDM4E
SCHEMBL19631467 0.85 DHODH (1.00) DHODHPOLBMAPTALDH1A1KDM4E

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
EP-3459937-B1 THIAZOLE DERIVATIVE AND APPLICATIONS UNIV EAST CHINA SCIENCE & TECH (CN) 2021-12-29 — — EP disclosed
EP-3459937-A1 THIAZOLE DERIVATIVE AND APPLICATIONS East China University of Science and Technology (CN) 2019-03-27 — — EP disclosed
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