SCHEMBL23915446

SCHEMBL23915446

COC(=O)Cc1nn(CC(=O)O)c2ccccc2c1=O

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.56
KDM4E B2RXH2 3/20 0.56
ALDH1A1 P00352 2/20 0.56
LMNA P02545 1/20 0.56
HPGD P15428 1/20 0.56
HTT P42858 1/20 0.56
KMT2A Q03164 1/20 0.56
HSD17B10 Q99714 2/20 0.52
ALOX15 P16050 1/20 0.48
GLA P06280 1/20 0.48
S1PR2 O95136 2/20 0.47
TSHR P16473 2/20 0.46
MAPT P10636 2/20 0.45
CMA1 P23946 1/20 0.45
RECQL P46063 1/20 0.43
EGFR P00533 1/20 0.42

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
SCHEMBL23909083 0.87 KDM4E (0.51) SMN1; SMN2KDM4EALDH1A1LMNAHPGD
SCHEMBL23908941 0.81 KDM4E (0.46) SMN1; SMN2KDM4EALDH1A1LMNAHPGD
SCHEMBL23909037 0.80 NPC1 (0.44) SMN1; SMN2KDM4EALDH1A1LMNAHPGD
SCHEMBL23914498 0.79 KDM4E (0.41) SMN1; SMN2KDM4EALDH1A1LMNAHPGD
SCHEMBL7745247 0.76 ELANE (0.60) SMN1; SMN2KDM4EALDH1A1LMNAHPGD
SCHEMBL23915450 0.76 ALDH1A1 (0.50) SMN1; SMN2KDM4EALDH1A1LMNAHPGD
SCHEMBL15622512 0.74 KDM4E (0.67) SMN1; SMN2KDM4EALDH1A1LMNAHPGD
SCHEMBL3354746 0.74 HSD17B10 (0.61) SMN1; SMN2KDM4EALDH1A1LMNAHPGD
SCHEMBL3354341 0.73 HSD17B10 (0.65) SMN1; SMN2KDM4EALDH1A1LMNAHPGD
SCHEMBL22061005 0.73 HSD17B10 (0.57) SMN1; SMN2KDM4EALDH1A1LMNAHPGD

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 2 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

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 2920/4885KDM4E 3835/4885ALDH1A1 944/4885

“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.