SCHEMBL23577908

SCHEMBL23577908

COC(=O)c1ccc2c(c1)N(C)C(=O)C2(O)C[N+](=O)[O-]

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CASP3 P42574 1/20 0.44
CHRM5 P08912 1/20 0.42
POLB P06746 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CBX7 O95931 1/20 0.40
CDYL2 Q8N8U2 1/20 0.40
CDYL Q9Y232 1/20 0.40
CDY1; CDY1B Q9Y6F8 1/20 0.40
VCAM1 P19320 1/20 0.40
ALDH1A1 P00352 4/20 0.39
LMNA P02545 1/20 0.39
RAD52 P43351 1/20 0.38
GAA P10253 3/20 0.38
TSHR P16473 1/20 0.38
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
PTPRC P08575 1/20 0.37
HTT P42858 1/20 0.37
KDM4E B2RXH2 1/20 0.37
ALOX15 P16050 1/20 0.37

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
SCHEMBL30183706 1.00 CASP3 (0.44) CASP3CHRM5POLBSMN1; SMN2CBX7
SCHEMBL23591099 0.84 CASP3 (0.46) CASP3POLBSMN1; SMN2CBX7CDYL2
SCHEMBL30183749 0.83 CASP3 (0.45) CASP3POLBSMN1; SMN2CBX7CDYL2
SCHEMBL23577606 0.83 CASP3 (0.45) CASP3POLBSMN1; SMN2CBX7CDYL2
SCHEMBL23591296 0.82 CASP3 (0.44) CASP3POLBSMN1; SMN2CBX7CDYL2
SCHEMBL38660490 0.79 CASP3 (0.41) CASP3POLBSMN1; SMN2CBX7CDYL2
SCHEMBL23578330 0.77 CASP3 (0.49) CASP3POLBSMN1; SMN2ALDH1A1LMNA
SCHEMBL30183667 0.77 CASP3 (0.49) CASP3POLBSMN1; SMN2ALDH1A1LMNA
SCHEMBL16377147 0.76 RAD52 (0.63) SMN1; SMN2CBX7CDYL2CDYLCDY1; CDY1B
SCHEMBL16324200 0.76 CASP3 (0.50) CASP3POLBSMN1; SMN2ALDH1A1LMNA

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
EP-4081521-B1 SUBSTITUTED TRICYCLIC COMPOUNDS LUPIN LTD (IN) 2025-12-10 EP disclosed
CN-115605476-B Substituted tricyclic compounds 鲁宾有限公司 2024-05-24 CN disclosed
US-20230119316-A1 Substituted Tricyclic Compounds LUPIN LIMITED (IN) 2023-04-20 US disclosed
CN-115605476-A Substituted tricyclic compounds 鲁宾有限公司(IN) 2023-01-13 CN disclosed
EP-4081521-A1 SUBSTITUTED TRICYCLIC COMPOUNDS Lupin Limited (IN) 2022-11-02 EP disclosed
WO-2021130731-A1 SUBSTITUTED TRICYCLIC COMPOUNDS LUPIN LIMITED (IN) 2021-07-01 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-20230119316-A1 Substituted Tricyclic Compounds SOS1, RSU1, KSR1 CASP3 3442/4885CHRM5 4231/4885POLB 1789/4885

“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.