SCHEMBL28912441

SCHEMBL28912441

CS(=O)(=O)C1=C(N)Oc2c(ccc3ccccc23)C1c1ccc(C#N)cc1

nearest known ligand 0.69

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MYB P10242 14/20 0.69
▸ MAPT P10636 3/20 0.50
▸ GAA P10253 2/20 0.50
▸ KDM4E B2RXH2 2/20 0.50
▸ RAB9A P51151 1/20 0.50
▸ L3MBTL1 Q9Y468 1/20 0.50
▸ MEN1 O00255 2/20 0.48
▸ LMNA P02545 2/20 0.48
▸ KMT2A Q03164 2/20 0.48
▸ NPSR1 Q6W5P4 2/20 0.48
▸ ALDH1A1 P00352 1/20 0.47
▸ CYP1A2 P05177 1/20 0.46

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
SCHEMBL28565266 0.87 MYB (0.51) MYBMAPTGAAKDM4ERAB9A
SCHEMBL28566464 0.86 MYB (0.63) MYBMAPTGAAKDM4ERAB9A
SCHEMBL28550404 0.85 MYB (0.50) MYBMAPTGAAKDM4ERAB9A
SCHEMBL28554145 0.85 MYB (0.50) MYBMAPTGAAKDM4ERAB9A
SCHEMBL28565268 0.83 MYB (0.65) MYBKDM4EMEN1KMT2ANPSR1
SCHEMBL8541683 0.76 MYB (0.67) MYBMAPTGAAKDM4ERAB9A
SCHEMBL31237908 0.73 MYB (0.83) MYBMAPTGAAKDM4ERAB9A
SCHEMBL14952244 0.71 MYB (0.77) MYBMAPTGAAKDM4ERAB9A
SCHEMBL8542412 0.70 MYB (0.81) MYBMAPTGAAKDM4ERAB9A
SCHEMBL14478939 0.69 MYB (0.76) MYBMAPTGAAKDM4ERAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108586419-B Method for preparing benzo chromene derivative under catalysis of ionic liquid 浙江工业大学 2021-03-30 — — CN disclosed
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