SCHEMBL23909017

SCHEMBL23909017

COC(=O)Cc1n[nH]c2ccccc2c1=O

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.66
KDM4E B2RXH2 7/20 0.52
STAT3 P40763 1/20 0.52
HIF1A Q16665 1/20 0.52
CYP1A2 P05177 1/20 0.50
ALDH1A1 P00352 4/20 0.49
MAPT P10636 2/20 0.48
EGFR P00533 2/20 0.47
YTHDC1 Q96MU7 1/20 0.46
HSD17B10 Q99714 1/20 0.45
NPC1 O15118 2/20 0.44
TP53 P04637 1/20 0.44
RAB9A P51151 1/20 0.44
GAA P10253 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
FLT3 P36888 2/20 0.43
CDK2 P24941 1/20 0.43
CTNNB1 P35222 2/20 0.43
WNT3A P56704 2/20 0.43
LMNA P02545 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
SCHEMBL4300704 0.90 SMN1; SMN2 (0.71) SMN1; SMN2KDM4ESTAT3HIF1AALDH1A1
SCHEMBL23914670 0.85 SMN1; SMN2 (0.48) SMN1; SMN2KDM4ESTAT3HIF1ACYP1A2
SCHEMBL23966522 0.83 ALDH1A1 (0.56) SMN1; SMN2KDM4ECYP1A2ALDH1A1MAPT
SCHEMBL23908935 0.82 LMNA (0.62) SMN1; SMN2KDM4ESTAT3HIF1ACYP1A2
SCHEMBL21591507 0.81 CYP1A2 (0.58) SMN1; SMN2KDM4ESTAT3HIF1ACYP1A2
SCHEMBL23914767 0.81 MAP2K4 (0.51) SMN1; SMN2CYP1A2MAPT
SCHEMBL23914681 0.80 SMN1; SMN2 (0.51) SMN1; SMN2KDM4ESTAT3HIF1AALDH1A1
SCHEMBL9328808 0.79 SMN1; SMN2 (1.00) SMN1; SMN2KDM4EALDH1A1MAPTGAA
SCHEMBL3035725 0.78 KDM4E (0.54) SMN1; SMN2KDM4ESTAT3HIF1AALDH1A1
SCHEMBL29589005 0.76 KDM4E (0.51) SMN1; SMN2KDM4ESTAT3HIF1ACYP1A2

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 SMN1; SMN2 2920/4885KDM4E 3835/4885STAT3 858/4885

“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.