SCHEMBL15033503

SCHEMBL15033503

CNC(=O)N1CCN(c2nsc3ccccc23)CC1

nearest known ligand 0.73

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.66
KDM4E B2RXH2 1/20 0.53
MAPT P10636 1/20 0.53
PHGDH O43175 1/20 0.53

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
SCHEMBL27571765 0.83 HCAR2 (0.65) HCAR2KDM4EMAPT
SCHEMBL13666108 0.80 HCAR2 (1.00) HCAR2
SCHEMBL9203345 0.80 HTR1A (0.74) HCAR2
SCHEMBL10469604 0.79 HTR1A (0.58) HCAR2
SCHEMBL24937833 0.78 HCAR2 (0.56) HCAR2KDM4EMAPT
SCHEMBL6884485 0.77 KDM4E (0.65) KDM4EMAPT
SCHEMBL9778394 0.76 PARP1 (0.49) KDM4EMAPT
Hydrochloric Acid SCHEMBL8401502 0.76 KDM4E (0.68) KDM4EMAPT
SCHEMBL24937770 0.75 HCAR2 (0.53) HCAR2KDM4EMAPT
SCHEMBL4558892 0.75 KDM4E (0.71) KDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130156795-A1 METHODS FOR INHIBITION OF CELL PROLIFERATION, SYNERGISTIC TRANSCRIPTION MODULES AND USES THEREOF THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK 2013-06-20 US disclosed
US-20130156795-A1 METHODS FOR INHIBITION OF CELL PROLIFERATION, SYNERGISTIC TRANSCRIPTION MODULES AND USES THEREOF THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK 2013-06-20 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-20130156795-A1 METHODS FOR INHIBITION OF CELL PROLIFERATION, SYNERGISTIC TRANSCRIPTION MODULES AND USES THEREOF MKI67, DCX, CTCF HCAR2 4395/4885KDM4E 1314/4885MAPT 4158/4885

“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.