SCHEMBL23909056

SCHEMBL23909056

COC(=O)Cc1n[nH]c(=O)c2ccc(OC)cc12

nearest known ligand 0.69

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.69
ALDH1A1 P00352 3/20 0.52
MAPT P10636 3/20 0.49
LMNA P02545 2/20 0.49
GAA P10253 1/20 0.49
PRMT5 O14744 4/20 0.47
WDR77 Q9BQA1 4/20 0.47
HPGD P15428 2/20 0.47
KDM4E B2RXH2 1/20 0.47
ENPP1 P22413 1/20 0.45

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
SCHEMBL23914748 0.89 SMN1; SMN2 (0.69) SMN1; SMN2ALDH1A1MAPTLMNAGAA
SCHEMBL6589678 0.82 PRMT5 (0.52) MAPTGAAPRMT5WDR77ENPP1
SCHEMBL9328808 0.82 SMN1; SMN2 (1.00) SMN1; SMN2ALDH1A1MAPTLMNAGAA
SCHEMBL6589118 0.80 SMN1; SMN2 (0.50) SMN1; SMN2ALDH1A1MAPTLMNAGAA
SCHEMBL4117496 0.76 GAA (0.51) SMN1; SMN2MAPTLMNAGAAPRMT5
SCHEMBL4131883 0.75 GAA (0.50) SMN1; SMN2MAPTLMNAGAAPRMT5
SCHEMBL26123136 0.75 PARP1 (0.59)
SCHEMBL4837939 0.75 MAPT (0.47) SMN1; SMN2ALDH1A1MAPTGAAPRMT5
SCHEMBL6585218 0.74 ALDH1A1 (0.53) SMN1; SMN2ALDH1A1MAPTLMNAGAA
SCHEMBL2305371 0.74 DYRK1A (0.59) SMN1; SMN2ALDH1A1MAPTLMNAGAA

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 4 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
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 SMN1; SMN2 2920/4885ALDH1A1 944/4885MAPT 4876/4885

“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.