SCHEMBL14424070

SCHEMBL14424070

CC(C)Cc1cnc(=O)[nH]c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.38
POLB P06746 1/20 0.38
MAPT P10636 1/20 0.38
KMT2A Q03164 1/20 0.38
LYN P07948 1/20 0.34
MMEL1 Q495T6 1/20 0.34
TSHR P16473 2/20 0.33
GAA P10253 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
XDH P47989 1/20 0.33
MET P08581 1/20 0.32
PDE3B Q13370 1/20 0.32
PDE3A Q14432 1/20 0.32
DAO P14920 1/20 0.32
MME P08473 1/20 0.31
PIK3CA P42336 1/20 0.31
PTGS1 P23219 3/20 0.31
PTGS2 P35354 3/20 0.31
LMNA P02545 2/20 0.31
CYP2C9 P11712 2/20 0.31

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
SCHEMBL29068210 0.74 NPC1 (0.35) MEN1MAPTKMT2ALYNTSHR
SCHEMBL4575793 0.69 LYN (0.37) LYNPIK3CA
SCHEMBL5988807 0.69 GABRA1 (0.46) MEN1POLBMAPTKMT2AMMEL1
SCHEMBL13772689 0.68 GAA (0.54) MEN1POLBMAPTKMT2ATSHR
SCHEMBL14466672 0.67 BRS3 (0.41) MEN1POLBMAPTKMT2AMMEL1
SCHEMBL5960562 0.67
Hydrochloric Acid SCHEMBL20958707 0.67 CHRNB2 (0.32) MET
SCHEMBL2625522 0.66 GABRA1 (0.38) POLBTSHRSMN1; SMN2PTGS1PTGS2
SCHEMBL312460 0.66
SCHEMBL18858528 0.66 GABRA1 (0.38) POLBTSHRSMN1; SMN2PTGS1PTGS2

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
US-20220395503-A1 PYRUVATE KINASE ACTIVATORS FOR USE IN TREATING BLOOD DISORDERS AGIOS PHARMACEUTICALS, INC. 2022-12-15 US disclosed
US-11364240-B2 Pyruvate kinase activators for use in treating blood disorders AGIOS PHARMACEUTICALS, INC. (US) 2022-06-21 US disclosed
US-20210130371-A1 PYRUVATE KINASE ACTIVATORS FOR USE IN TREATING BLOOD DISORDERS AGIOS PHARMACEUTICALS, INC. 2021-05-06 US disclosed
US-7262186-B2 Substituted pyrazolo[3,4-d] pyrimidinones as a mitotic kinesin inhibitor MERCK & CO., INC. (US) 2007-08-28 US disclosed
US-7244723-B2 Substituted furopyrimidinones as a mitotic kinesin inhibitors MERCK & CO., INC. (US) 2007-07-17 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 (3 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-11364240-B2 Pyruvate kinase activators for use in treating blood disorders PDK1, PDK2, PDK3 MEN1 3431/4885POLB 1880/4885MAPT 3448/4885
US-20210130371-A1 PYRUVATE KINASE ACTIVATORS FOR USE IN TREATING BLOOD DISORDERS PDK1, PDK2, PDK3 MEN1 3431/4885POLB 1880/4885MAPT 3448/4885
US-20220395503-A1 PYRUVATE KINASE ACTIVATORS FOR USE IN TREATING BLOOD DISORDERS PDK1, PDK2, PDK3 MEN1 3431/4885POLB 1880/4885MAPT 3448/4885

“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.