SCHEMBL20439185

SCHEMBL20439185

C/C=C\C(=C/C)CN1C(=O)c2ccc([N+](=O)[O-])cc2C1=O

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 1/20 0.51
▸ KMT2A Q03164 2/20 0.48
▸ ACHE P22303 1/20 0.48
▸ KDM4E B2RXH2 2/20 0.47
▸ ALDH1A1 P00352 2/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.47
▸ LMNA P02545 1/20 0.47
▸ CA12 O43570 1/20 0.47
▸ CA1 P00915 1/20 0.47
▸ CA2 P00918 1/20 0.47
▸ CA9 Q16790 1/20 0.47
▸ LPAR3 Q9UBY5 1/20 0.46
▸ MEN1 O00255 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
SCHEMBL12731847 0.80 KDM4E (0.58) ALOX5KMT2AACHEKDM4EALDH1A1
SCHEMBL4234480 0.78 LPAR3 (0.69) ALOX5KMT2AKDM4EALDH1A1L3MBTL1
SCHEMBL7504758 0.77 ALOX5 (0.57) ALOX5KMT2AACHEKDM4EALDH1A1
SCHEMBL1122540 0.76 ALOX5 (0.53) ALOX5KMT2AACHEKDM4EALDH1A1
SCHEMBL14876485 0.76 ALOX5 (0.56) ALOX5KMT2AKDM4EALDH1A1L3MBTL1
SCHEMBL28639253 0.76 ALOX5 (0.62) ALOX5KMT2AACHEKDM4EALDH1A1
SCHEMBL6207633 0.76 ALOX5 (0.62) ALOX5ACHEKDM4EALDH1A1L3MBTL1
SCHEMBL30070354 0.76 ALOX5 (0.62) ALOX5ACHEKDM4EALDH1A1L3MBTL1
SCHEMBL522710 0.74 PIN1 (0.62) ALOX5KMT2AKDM4EALDH1A1L3MBTL1
SCHEMBL8686545 0.74 ALOX5 (0.57) ALOX5KMT2AACHEKDM4EALDH1A1

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
US-20190225591-A1 PROCESS FOR PREPARING 5-PHENOXY-1(3)ISOBENZOFURANONE KINGCHEM LIFE SCIENCE LLC 2019-07-25 — — US disclosed
WO-2018140186-A1 A PROCESS FOR PREPARING 5-PHENOXY-1(3H)ISOBENZOFURANONE KINGCHEM LIFE SCIENCE LLC (US) 2018-08-02 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20190225591-A1 PROCESS FOR PREPARING 5-PHENOXY-1(3)ISOBENZOFURANONE PPOX, KCNA5, KCNH2 ALOX5 1076/4885KMT2A 622/4885ACHE 1149/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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