SCHEMBL7239293

SCHEMBL7239293

O=C(NC1CCCCC1)c1ccc(O)nc1

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 3/20 0.59
NPC1 O15118 3/20 0.58
RAB9A P51151 3/20 0.58
HPGD P15428 2/20 0.58
CYP1A2 P05177 1/20 0.58
CYP2C19 P33261 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
KMT2A Q03164 2/20 0.54
ALDH1A1 P00352 1/20 0.53
TSHR P16473 1/20 0.53
MAOA P21397 1/20 0.51
MAOB P27338 1/20 0.51

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
SCHEMBL21489868 0.85 SMYD3 (0.57)
SCHEMBL19701339 0.85 SMYD3 (0.57)
SCHEMBL2159094 0.83 GRM5 (0.57) GRM5NPC1RAB9AHPGDCYP1A2
SCHEMBL1969968 0.83 GRM5 (0.57) GRM5NPC1RAB9AHPGDCYP1A2
SCHEMBL5429264 0.83 NPC1 (0.65) GRM5NPC1RAB9AHPGDCYP1A2
SCHEMBL5429612 0.83 NPC1 (0.65) GRM5NPC1RAB9AHPGDCYP1A2
SCHEMBL5424850 0.81 NPC1 (0.62) GRM5NPC1RAB9AHPGDCYP1A2
SCHEMBL3244479 0.81 ALDH1A1 (0.57) GRM5NPC1RAB9AHPGDCYP1A2
SCHEMBL28928584 0.81 NPC1 (0.82) NPC1RAB9AHPGDCYP1A2CYP2C19
SCHEMBL520877 0.81 NPC1 (0.82) NPC1RAB9AHPGDCYP1A2CYP2C19

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
US-6544986-B2 Such as 5-(N,N-dibenzyl)aminocarbonyl-2-pyridone; enzyme inhibitors; for treatment of Alzheimer's disease DALHOUSIE UNIVERSITY (CA) 2003-04-08 US disclosed
US-6436972-B1 HETEROCYCLIC AMIDES, USED AS ANTICHOLINERGICS AND SERINE PROTEASE STIMULANTS, FOR PROPHYLAXIS OF ALZHEIMER'S DISEASE, GLIOMAS AND VISION DEFECTS DALHOUSIE UNIVERSITY (CA) 2002-08-20 US disclosed
US-20020049330-A1 Novel pyridones and their use as modulators of serine hydrolase enzymes DALHOUSIE UNIVERSITY 2002-04-25 US disclosed
WO-2001077078-A1 NOVEL PYRIDONES AND THEIR USE AS MODULATORS OF SERINE HYDROLASE ENZYMES DALHOUSIE UNIVERSITY (CA) 2001-10-18 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-20020049330-A1 Novel pyridones and their use as modulators of serine hydrolase enzymes BCHE, PRSS1, BACE1 GRM5 1525/4885NPC1 2234/4885RAB9A 2623/4885

“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.