SCHEMBL9382270

SCHEMBL9382270

C#CCn1sc2ccccc2c1=O

nearest known ligand 0.66

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ CASP3 P42574 5/20 0.62
▸ FAAH O00519 2/20 0.53
▸ MGLL Q99685 2/20 0.53
▸ KAT2A Q92830 1/20 0.51
▸ KAT2B Q92831 1/20 0.51

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
SCHEMBL28639402 0.83 CASP3 (0.60) CASP3FAAHMGLLKAT2AKAT2B
SCHEMBL10921721 0.83 CASP3 (0.62) CASP3FAAHMGLLKAT2AKAT2B
SCHEMBL2963555 0.80 CASP3 (0.68) CASP3FAAHMGLLKAT2AKAT2B
SCHEMBL11278746 0.80 CASP3 (0.74) CASP3FAAHMGLLKAT2AKAT2B
SCHEMBL17948304 0.80 CASP3 (0.72) CASP3FAAHMGLLKAT2AKAT2B
SCHEMBL24836229 0.77 FAAH (0.76) CASP3FAAHMGLLKAT2AKAT2B
SCHEMBL3143600 0.77 CASP3 (1.00) CASP3FAAHMGLLKAT2AKAT2B
SCHEMBL16071405 0.77 CASP3 (0.68) CASP3FAAHMGLLKAT2AKAT2B
SCHEMBL24836231 0.77 FAAH (0.81) CASP3FAAHMGLLKAT2AKAT2B
SCHEMBL29678965 0.77 CASP3 (1.00) CASP3FAAHMGLLKAT2AKAT2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220380383-A1 NEUROPROTECTIVE PDI MODULATING SMALL MOLECULES AND METHODS OF USE THEREOF THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK 2022-12-01 — — US disclosed
CN-109942505-B Isothiazolinone compounds and corresponding use 华东理工大学 2021-08-27 — — CN disclosed
WO-2020113222-A1 NEUROPROTECTIVE PDI MODULATING SMALL MOLECULES AND METHODS OF USE THEREOF THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2020-06-04 — — WO disclosed
US-20160311973-A1 CLICKABLE WATERBORNE POLYMERS AND CLICK-CROSSLINKED WATERBORNE POLYMERS, CLICKABLE FUNCTIONAL COMPOUNDS, CLICK FUNCTIONALIZED WATERBORNE POLYMERS, AND USES THEREOF THE PENN STATE RESEARCH FOUNDATION 2016-10-27 — — US disclosed
EP-0320992-B1 Triazolodiazepine derivatives HOFFMANN LA ROCHE (CH) 1994-07-27 — — EP disclosed
EP-0320992-A2 Triazolodiazepine derivatives F. HOFFMANN-LA ROCHE AG (CH) 1989-06-21 — — EP 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-20220380383-A1 NEUROPROTECTIVE PDI MODULATING SMALL MOLECULES AND METHODS OF USE THEREOF NLN, PDIA5, PRNP CASP3 781/4885FAAH 1657/4885MGLL 2410/4885

“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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