SCHEMBL13039605

SCHEMBL13039605

NOCC(=O)N1CCCC1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 2/20 0.50
▸ ALDH1A1 P00352 3/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ RAB9A P51151 4/20 0.44
▸ HPGD P15428 2/20 0.44
▸ POLB P06746 1/20 0.44
▸ MAPT P10636 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ NPC1 O15118 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
SCHEMBL4503439 0.98 ATM (0.48) ATMALDH1A1SMN1; SMN2RAB9AHPGD
SCHEMBL14538084 0.98 ATM (0.48) ATMALDH1A1SMN1; SMN2RAB9AHPGD
SCHEMBL14538018 0.81 ALDH1A1 (0.36) ATMALDH1A1POLBL3MBTL1LMNA
SCHEMBL14538081 0.80 L3MBTL1 (0.70) ALDH1A1SMN1; SMN2RAB9AHPGDPOLB
SCHEMBL5181688 0.80 TPSAB1 (0.51) ALDH1A1POLBL3MBTL1MEN1KMT2A
SCHEMBL14538019 0.80 ACHE (0.54) ALDH1A1SMN1; SMN2L3MBTL1MEN1KMT2A
Hydrochloric Acid SCHEMBL3724641 0.79 L3MBTL1 (0.68) ALDH1A1SMN1; SMN2RAB9AHPGDPOLB
SCHEMBL19703776 0.77 ALDH1A1 (0.58) ATMALDH1A1RAB9AHPGDMAPT
SCHEMBL944668 0.76 ALDH1A1 (0.53) ATMALDH1A1SMN1; SMN2RAB9AHPGD
SCHEMBL28716383 0.76 ALDH1A1 (0.50) ATMALDH1A1SMN1; SMN2RAB9AHPGD

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
WO-2021038241-A1 TRIAZINE DERIVATIVES FOR TREATING DISEASES RELATING TO NEUROTROPHINS AlzeCure Pharma AB (SE) 2021-03-04 — — WO disclosed
US-20100279963-A1 DICARBONYL DERIVATIVES AND METHODS OF USE ABRAXIS BIOSCIENCE, LLC (US) 2010-11-04 — — US disclosed
US-7799954-B2 Dicarbonyl derivatives and methods of use ABRAXIS BIOSCIENCE, LLC (US) 2010-09-21 — — US disclosed
US-20080146586-A1 DICARBONYL DERIVATIVES AND METHODS OF USE ABRAXIS BIOSCIENCE (US) 2008-06-19 — — US disclosed
WO-2007059116-A2 GELDANAMYCIN DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS THEREOF ABRAXIS BIOSCIENCE, INC. (US) 2007-05-24 — — 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 (2 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-20080146586-A1 DICARBONYL DERIVATIVES AND METHODS OF USE AADAC, DCK, MLYCD ATM 1173/4885ALDH1A1 1688/4885SMN1; SMN2 3902/4885
US-20100279963-A1 DICARBONYL DERIVATIVES AND METHODS OF USE AADAC, DCK, MLYCD ATM 1173/4885ALDH1A1 1688/4885SMN1; SMN2 3902/4885

“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.

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