SCHEMBL13136708

SCHEMBL13136708

CCOC(=O)Cc1cscc1NC(=O)OC(C)(C)C

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.41
LMNA P02545 2/20 0.39
ALDH1A1 P00352 2/20 0.39
KCNH2 Q12809 1/20 0.39
MAPK1 P28482 2/20 0.39
TSHR P16473 1/20 0.39
PTPRB P23467 1/20 0.39
GAA P10253 1/20 0.38
HTT P42858 2/20 0.37
CYP1A2 P05177 1/20 0.37
CYP2C9 P11712 1/20 0.37
CYP2C19 P33261 1/20 0.37
NLRP3 Q96P20 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
ABCB1 P08183 1/20 0.36

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
SCHEMBL3633543 0.83 PTGDR2 (0.40)
SCHEMBL27399409 0.80 METAP1 (0.39) GAAMEN1KMT2A
SCHEMBL23617019 0.79 KMT2A (0.42) SMN1; SMN2LMNAALDH1A1MAPK1TSHR
SCHEMBL1066439 0.78 METAP1 (0.45) LMNA
SCHEMBL21455162 0.77 KMT2A (0.41) SMN1; SMN2LMNAALDH1A1MAPK1TSHR
SCHEMBL17164920 0.77 EGFR (0.49) SMN1; SMN2L3MBTL1ALDH1A1CYP1A2CYP2C9
SCHEMBL23218723 0.77 NLRP3 (0.45) L3MBTL1LMNAALDH1A1HTTNLRP3
SCHEMBL3039310 0.75 MAPT (0.49)
SCHEMBL944756 0.74 SMN1; SMN2 (0.73) SMN1; SMN2L3MBTL1LMNAALDH1A1KCNH2
SCHEMBL9481298 0.74 SMN1; SMN2 (0.47) SMN1; SMN2LMNAALDH1A1KCNH2MAPK1

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
WO-2024020379-A2 PRODRUGS, PRODRUG COMPOSITIONS AND RELATED METHODS PRAESIDIA BIOTHERAPEUTICS INC. (US) 2024-01-25 WO disclosed
US-20100222326-A1 New Heterocyclic Derivatives Useful For The Treatment of CNS Disorders UCB PHARMA, S.A. (BE) 2010-09-02 US disclosed
US-20100222326-A1 New Heterocyclic Derivatives Useful For The Treatment of CNS Disorders UCB PHARMA, S.A. (BE) 2010-09-02 US disclosed
WO-2008132142-A2 NEW HETEROCYCLIC DERIVATIVES USEFUL FOR THE TREATMENT OF CNS DISORDERS UCB PHARMA S.A. (BE) 2008-11-06 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-20100222326-A1 New Heterocyclic Derivatives Useful For The Treatment of CNS Disorders CNR2, CNR1, SLC18A2 SMN1; SMN2 144/4885L3MBTL1 4838/4885LMNA 1995/4885

“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.