SCHEMBL22320776

SCHEMBL22320776

N#C/C(=N\Nc1cc(Cl)cc(Cl)c1)C(=O)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.72

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RAPGEF3 O95398 15/20 0.72
RAPGEF4 Q8WZA2 7/20 0.72
MAPT P10636 3/20 0.70
HTT P42858 3/20 0.70
SMN1; SMN2 Q16637 3/20 0.70
LMNA P02545 2/20 0.70
MEN1 O00255 2/20 0.70
KMT2A Q03164 2/20 0.70
ALOX12 P18054 1/20 0.67
NPY1R P25929 1/20 0.67
NPY2R P49146 1/20 0.67
NPSR1 Q6W5P4 1/20 0.67
HPGD P15428 1/20 0.56
CRHBP P24387 1/20 0.56
CRHR2 Q13324 1/20 0.56

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
SCHEMBL22340245 0.92 MAPT (0.81) RAPGEF3RAPGEF4MAPTHTTSMN1; SMN2
SCHEMBL20523731 0.88 RAPGEF3 (0.75) RAPGEF3RAPGEF4MAPTHTTSMN1; SMN2
SCHEMBL20523734 0.88 RAPGEF3 (0.75) RAPGEF3RAPGEF4MAPTHTTSMN1; SMN2
SCHEMBL20523744 0.88 RAPGEF3 (0.79) RAPGEF3RAPGEF4MAPTHTTSMN1; SMN2
SCHEMBL20523640 0.84 RAPGEF3 (1.00) RAPGEF3RAPGEF4MAPTHTTSMN1; SMN2
SCHEMBL20523757 0.82 LMNA (0.77) RAPGEF3RAPGEF4MAPTHTTSMN1; SMN2
SCHEMBL20523638 0.81 RAPGEF3 (1.00) RAPGEF3RAPGEF4MAPTHTTSMN1; SMN2
SCHEMBL22340226 0.80 RAPGEF3 (0.70) RAPGEF3RAPGEF4MAPTHTTSMN1; SMN2
SCHEMBL20523762 0.79 RAPGEF3 (1.00) RAPGEF3RAPGEF4MAPTHTTSMN1; SMN2
SCHEMBL922712 0.78 MAPT (0.81) RAPGEF3RAPGEF4MAPTHTTSMN1; SMN2

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-11124489-B2 EPAC antagonists BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2021-09-21 US disclosed
US-20200255388-A1 EPAC ANTAGONISTS THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 2020-08-13 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 (2 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-20200255388-A1 EPAC ANTAGONISTS EPAS1, GPR139, CRACR2A RAPGEF3 5/4885RAPGEF4 7/4885MAPT 4650/4885
US-11124489-B2 EPAC antagonists EPAS1, GPR139, CRACR2A RAPGEF3 5/4885RAPGEF4 7/4885MAPT 4650/4885

“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.