SCHEMBL22629334

SCHEMBL22629334

COC(=O)C1CCC(N=[N+]=[N-])C(O)C1

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MMP2 P08253 1/20 0.40
▸ ANPEP P15144 1/20 0.40
▸ CHRNB2 P17787 2/20 0.34
▸ CHRNA4 P43681 2/20 0.34
▸ CHRNB4 P30926 1/20 0.34
▸ CHRNA3 P32297 1/20 0.34
▸ CHRNA7 P36544 1/20 0.34
▸ TP53 P04637 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL25286492 1.00 MMP2 (0.40) MMP2ANPEPCHRNB2CHRNA4CHRNB4
SCHEMBL13672052 1.00 MMP2 (0.40) MMP2ANPEPCHRNB2CHRNA4CHRNB4
SCHEMBL14403910 1.00 MMP2 (0.40) MMP2ANPEPCHRNB2CHRNA4CHRNB4
SCHEMBL13672046 1.00 MMP2 (0.40) MMP2ANPEPCHRNB2CHRNA4CHRNB4
SCHEMBL14403914 0.88 MMP2 (0.40) MMP2ANPEPCHRNB2CHRNA4CHRNB4
SCHEMBL31664512 0.87 MMP2 (0.42) MMP2ANPEPCHRNB2CHRNA4CHRNB4
SCHEMBL27740704 0.87 MMP2 (0.42) MMP2ANPEPCHRNB2CHRNA4CHRNB4
SCHEMBL15796255 0.87 MMP2 (0.42) MMP2ANPEPCHRNB2CHRNA4CHRNB4
SCHEMBL13631040 0.82 MMP2 (0.31) MMP2ANPEP
SCHEMBL13696040 0.80 CHRNB2 (0.47) MMP2ANPEPCHRNB2CHRNA4CHRNB4

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
US-20200345700-A1 LSD1 INHIBITOR AND PREPARATION METHOD AND APPLICATION THEREOF MEDSHINE DISCOVERY INC. (CN) 2020-11-05 — — US 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-20200345700-A1 LSD1 INHIBITOR AND PREPARATION METHOD AND APPLICATION THEREOF KDM1B, KDM1A, KDM2A MMP2 2144/4885ANPEP 2777/4885CHRNB2 2469/4885

“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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