SCHEMBL87421

SCHEMBL87421

CCCCOC(=O)NC1CCC(N)CC1

nearest known ligand 0.63

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.52
MAPK1 P28482 1/20 0.52
HTT P42858 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
SMYD3 Q9H7B4 3/20 0.51
EPHX1 P07099 3/20 0.48
NAAA Q02083 2/20 0.43
ACHE P22303 6/20 0.41

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
SCHEMBL84042 1.00 GAA (0.52) GAAMAPK1HTTSMN1; SMN2SMYD3
SCHEMBL23901023 0.94 GAA (0.60) GAAMAPK1HTTSMN1; SMN2SMYD3
SCHEMBL4719490 0.92 GAA (0.59) GAAMAPK1HTTSMN1; SMN2EPHX1
SCHEMBL13387564 0.92 GAA (0.59) GAAMAPK1HTTSMN1; SMN2EPHX1
SCHEMBL30827617 0.91 GAA (0.50) GAAMAPK1HTTSMN1; SMN2SMYD3
SCHEMBL16526220 0.86 GAA (0.66) GAAMAPK1HTTSMN1; SMN2EPHX1
SCHEMBL23199587 0.85 GAA (0.50) GAAMAPK1HTTSMN1; SMN2EPHX1
SCHEMBL8260235 0.85 GAA (0.54) GAAMAPK1HTTSMN1; SMN2EPHX1
SCHEMBL8259162 0.85 GAA (0.54) GAAMAPK1HTTSMN1; SMN2EPHX1
SCHEMBL2575225 0.85 GAA (0.54) GAAMAPK1HTTSMN1; SMN2EPHX1

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024105007-A1 AUTOPHAGY INDUCING COMPOUNDS AND USES THEREOF Samsara Therapeutics Inc. (US) 2024-05-23 WO disclosed
WO-2023212147-A1 HETEROCYCLIC COMPOUNDS AS MODULATORS OF BCL6 AS LIGAND DIRECTED DEGRADERS CELGENE CORPORATION (US) 2023-11-02 WO disclosed
EP-4003980-A1 HETEROBICYCLIC AMIDES AS INHIBITORS OF CD38 Ribon Therapeutics Inc. (US) 2022-06-01 EP disclosed
CN-113121562-A Polycyclic compounds as inhibitors of bruton's tyrosine kinase 詹森药业有限公司 2021-07-16 CN disclosed
CN-105246883-A Dna-pk inhibitors VERTEX PHARMA 2016-01-13 CN disclosed
US-8129425-B2 Contacting cell with hedgehog antagonist; moderator of cell proliferative, cell differentiation CURIS, INC. (US) 2012-03-06 US disclosed
US-20060287385-A1 Small organic molecule regulators of cell proliferation CURIS, INC. 2006-12-21 US disclosed
CN-1860113-A Nicotinamide derivatives useful as PDE4 inhibitors PFIZER (US) 2006-11-08 CN disclosed
US-7115653-B2 Small organic molecule regulators of cell proliferation CURIS, INC. (US) 2006-10-03 US disclosed
EP-1436287-A4 SMALL ORGANIC MOLECULE REGULATORS OF CELL PROLIFERATION CURIS INC (US) 2005-10-26 EP disclosed
US-20050070578-A1 Small organic molecule regulators of cell proliferation CURIS, INC. 2005-03-31 US disclosed
EP-1436287-A2 SMALL ORGANIC MOLECULE REGULATORS OF CELL PROLIFERATION Curis, Inc. (US) 2004-07-14 EP disclosed
WO-2003027234-A9 SMALL ORGANIC MOLECULE REGULATORS OF CELL PROLIFERATION CURIS INC (US) 2004-02-19 WO disclosed
US-20030139457-A1 Small organic molecule regulators of cell proliferation CURIS, INC. 2003-07-24 US disclosed
WO-2003027234-A2 SMALL ORGANIC MOLECULE REGULATORS OF CELL PROLIFERATION CURIS, INC. (US) 2003-04-03 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 (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-20060287385-A1 Small organic molecule regulators of cell proliferation GLI1, SHH, SMO GAA 3845/4885MAPK1 870/4885HTT 2289/4885
US-20030139457-A1 Small organic molecule regulators of cell proliferation GLI1, SHH, SMO GAA 3845/4885MAPK1 870/4885HTT 2289/4885
US-20050070578-A1 Small organic molecule regulators of cell proliferation GLI1, SHH, SMO GAA 3845/4885MAPK1 870/4885HTT 2289/4885

“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.