SCHEMBL23908904

SCHEMBL23908904

CCOC(=O)c1nn(CC(=O)O)c2ccccc2c1=O

nearest known ligand 0.55

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ELANE P08246 12/20 0.55
HSD17B10 Q99714 1/20 0.52
F2 P00734 1/20 0.52
PLAU P00749 1/20 0.52
F2RL3 Q96RI0 1/20 0.48
GLA P06280 1/20 0.48
KDM4E B2RXH2 2/20 0.47
RXFP1 Q9HBX9 1/20 0.47
POLB P06746 1/20 0.47

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
SCHEMBL10164962 0.88 F2RL3 (0.64) ELANEF2PLAUF2RL3POLB
SCHEMBL23914718 0.86 ELANE (0.48) ELANEF2PLAUKDM4ERXFP1
SCHEMBL13885817 0.82 ALDH1A1 (0.62) ELANEHSD17B10F2PLAUKDM4E
SCHEMBL13885818 0.81 ELANE (0.56) ELANEF2PLAUF2RL3
SCHEMBL16377892 0.80 PTGER4 (0.56) ELANEF2PLAUF2RL3POLB
SCHEMBL13885730 0.80 ELANE (0.54) ELANEF2PLAU
SCHEMBL16378028 0.79 F2RL3 (0.57) ELANEF2PLAUF2RL3
SCHEMBL7745247 0.79 ELANE (0.60) ELANEHSD17B10F2PLAUGLA
SCHEMBL3806317 0.78 F2RL3 (0.48) ELANEF2PLAUF2RL3KDM4E
SCHEMBL17321351 0.77 ELANE (0.66) ELANEF2PLAUPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3649119-B1 NOVEL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF FIBROSIS GALAPAGOS NV (BE) 2021-11-03 EP disclosed
EP-3649119-B1 NOVEL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF FIBROSIS GALAPAGOS NV (BE) 2021-11-03 EP disclosed
US-20210315893-A1 NOVEL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF FIBROSIS GILEAD SCIENCES, INC. 2021-10-14 US disclosed
US-20210315893-A1 NOVEL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF FIBROSIS GILEAD SCIENCES, INC. 2021-10-14 US disclosed
CN-110869359-A Novel compounds and pharmaceutical compositions thereof for the treatment of fibrosis 加拉帕戈斯股份有限公司 2020-03-06 CN 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-20210315893-A1 NOVEL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF FIBROSIS S1PR1, S1PR3, S1PR2 ELANE 1350/4885HSD17B10 2447/4885F2 282/4885

“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.