SCHEMBL23657699

SCHEMBL23657699

c1ccc2c(c1)CC(C1CCC3NCNC3C1)CN2

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 1/20 0.35
MTNR1B P49286 1/20 0.35
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
EPHX2 P34913 1/20 0.33
ALOX15 P16050 1/20 0.30
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL17785670 0.81 MTNR1A (0.43) MTNR1AMTNR1BMEN1KMT2AEPHX2
SCHEMBL28543039 0.73 MTNR1A (0.40) MTNR1AMTNR1BMEN1KMT2AEPHX2
SCHEMBL23657803 0.72 MTNR1A (0.39) MTNR1AALOX15HSD17B10
SCHEMBL17194140 0.70 ACHE (0.44) MTNR1AMTNR1BMEN1KMT2AEPHX2
SCHEMBL27566376 0.66 MTNR1A (0.44) MTNR1AMTNR1BMEN1KMT2AEPHX2
SCHEMBL2030277 0.62 PLAU (0.45) MTNR1AMTNR1BMEN1KMT2AEPHX2
SCHEMBL12475851 0.62 GAA (0.47) MTNR1A
SCHEMBL3825586 0.62 PLAU (0.45) MTNR1AMTNR1BMEN1KMT2AEPHX2
SCHEMBL9965445 0.62 BRD4 (0.55) MTNR1AMTNR1BMEN1KMT2AEPHX2
SCHEMBL2152470 0.62 MTNR1A (0.47) MTNR1AMTNR1BMEN1KMT2AEPHX2

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-20210220408-A1 ARYL HYDROCARBON RECEPTOR ANTAGONISTS AND METHODS OF USE EDIGENE BIOTECHNOLOGY, INC. (CN) 2021-07-22 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-20210220408-A1 ARYL HYDROCARBON RECEPTOR ANTAGONISTS AND METHODS OF USE AHR, ARNT, ARSA MTNR1A 28/4885MTNR1B 35/4885MEN1 4634/4885

“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.