SCHEMBL4912079

SCHEMBL4912079

Cc1cccc(NC(=O)CN2C(=O)C(c3ccccc3)=NC23CCC(C)CC3)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 11/20 1.00
TP53 P04637 4/20 0.72
ALDH1A1 P00352 3/20 0.59
HPGD P15428 1/20 0.59
LMNA P02545 2/20 0.59
GAA P10253 1/20 0.55
HTT P42858 1/20 0.51
DRD2 P14416 1/20 0.50
DRD4 P21917 1/20 0.50
DRD3 P35462 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48

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
SCHEMBL4913443 0.91 MAPT (0.84) MAPTTP53ALDH1A1HPGDLMNA
SCHEMBL4910076 0.91 MAPT (0.82) MAPTTP53ALDH1A1HPGDLMNA
SCHEMBL4913433 0.90 MAPT (0.82) MAPTTP53ALDH1A1HPGDLMNA
SCHEMBL4915690 0.90 MAPT (0.81) MAPTTP53ALDH1A1HPGDLMNA
SCHEMBL4903807 0.90 MAPT (0.81) MAPTTP53ALDH1A1HPGDLMNA
SCHEMBL4911062 0.86 MAPT (0.85) MAPTTP53ALDH1A1HPGDLMNA
SCHEMBL4910744 0.85 MAPT (0.77) MAPTTP53ALDH1A1HPGDLMNA
SCHEMBL4912962 0.85 MAPT (0.86) MAPTTP53ALDH1A1HPGDLMNA
SCHEMBL4911264 0.84 MAPT (0.81) MAPTTP53ALDH1A1HPGDLMNA
SCHEMBL4903826 0.84 MAPT (1.00) MAPTTP53ALDH1A1HPGDLMNA

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-20080221185-A1 Glyt1 Transporter Inhibitors and Uses Thereof in Treatment of Neurological and Neuropsychiatric Disorders GLAXO GROUP LIMITED (GB) 2008-09-11 US claimed
US-20080221185-A1 Glyt1 Transporter Inhibitors and Uses Thereof in Treatment of Neurological and Neuropsychiatric Disorders GLAXO GROUP LIMITED (GB) 2008-09-11 US disclosed
US-20080221185-A1 Glyt1 Transporter Inhibitors and Uses Thereof in Treatment of Neurological and Neuropsychiatric Disorders GLAXO GROUP LIMITED (GB) 2008-09-11 US disclosed
US-20080221185-A1 Glyt1 Transporter Inhibitors and Uses Thereof in Treatment of Neurological and Neuropsychiatric Disorders GLAXO GROUP LIMITED (GB) 2008-09-11 US disclosed
WO-2007014762-A2 GLYT1 TRANSPORTER INHIBITORS AND USES THEREOF IN TREATMENT OF NEUROLOGICAL AND NEUROPSYCHIATRIC DISORDERS GLAXO GROUP LIMITED (GB) 2007-02-08 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-20080221185-A1 Glyt1 Transporter Inhibitors and Uses Thereof in Treatment of Neurological and Neuropsychiatric Disorders SLC18A2, SLC6A3, SLC1A2 MAPT 277/4885TP53 4008/4885ALDH1A1 1028/4885

“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.