SCHEMBL23206014

SCHEMBL23206014

Cc1cn(Cc2ncc[nH]2)cn1

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.50
TAAR1 Q96RJ0 9/20 0.41
ALDH1A1 P00352 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HTR1A P08908 1/20 0.36
TERT O14746 1/20 0.35
ALPL P05186 2/20 0.34
PLAA Q9Y263 1/20 0.34
ALPG P10696 1/20 0.33
FDPS P14324 1/20 0.33

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
SCHEMBL7277261 0.73 ALOX15 (0.52) ALOX15SMN1; SMN2
SCHEMBL3511243 0.68 ALOX15 (0.50) ALOX15TAAR1ALDH1A1HTR1AFDPS
SCHEMBL4397237 0.68
SCHEMBL15329166 0.67 ALOX15 (1.00) ALOX15TAAR1ALDH1A1TERTFDPS
SCHEMBL7300422 0.67
SCHEMBL1196872 0.67 HPGDS (0.51)
SCHEMBL10529956 0.66
SCHEMBL2969002 0.66
Bromide SCHEMBL28926580 0.66
Hydrochloric Acid SCHEMBL28156706 0.66

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210101887-A1 ISOINDOLINONE INHIBITORS OF THE MDM2-P53 INTERACTION AND PROCESS FOR MAKING THEM ASTEX THERAPEUTICS LIMITED (GB) 2021-04-08 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 (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-20210101887-A1 ISOINDOLINONE INHIBITORS OF THE MDM2-P53 INTERACTION AND PROCESS FOR MAKING THEM MDM2, TP53, TP53BP1 ALOX15 3115/4885TAAR1 4666/4885ALDH1A1 192/4885

“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.