SCHEMBL22554074

SCHEMBL22554074

CN(C)C(=O)c1cnc2[nH]cc(Br)c2c1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAP4K1 Q92918 6/20 0.48
CYP3A4 P08684 4/20 0.48
ABL1 P00519 3/20 0.45
AXL P30530 1/20 0.41
DYRK1B Q9Y463 3/20 0.38
IGF1R P08069 4/20 0.37
TNIK Q9UKE5 1/20 0.37
CLK1 P49759 1/20 0.37
DYRK1A Q13627 1/20 0.37
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
BRAF P15056 1/20 0.36
MAP3K11 Q16584 1/20 0.35

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
SCHEMBL30731147 1.00 MAP4K1 (0.48) MAP4K1CYP3A4ABL1AXLDYRK1B
SCHEMBL30731143 0.83 SGK1 (0.45) AXLDYRK1BCLK1DYRK1ABRAF
SCHEMBL22554203 0.83 SGK1 (0.45) AXLDYRK1BCLK1DYRK1ABRAF
SCHEMBL22554109 0.81 AXL (0.45) ABL1AXLDYRK1BIGF1RCLK1
SCHEMBL30731289 0.81 AXL (0.45) ABL1AXLDYRK1BIGF1RCLK1
SCHEMBL22554153 0.81 DYRK1A (0.47) AXLDYRK1BTNIKCLK1DYRK1A
SCHEMBL30731267 0.81 DYRK1A (0.47) AXLDYRK1BTNIKCLK1DYRK1A
SCHEMBL20780050 0.81 AXL (0.47) AXL
SCHEMBL30504208 0.81 AXL (0.47) AXL
SCHEMBL18250580 0.76 MAP4K1 (0.43) MAP4K1CYP3A4ABL1DYRK1BIGF1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11919902-B2 Aryl-bipyridine amine derivatives as phosphatidylinositol phosphate kinase inhibitors HIBERCELL, INC. (US) 2024-03-05 US disclosed
EP-3728230-A1 ARYL-BIPYRIDINE AMINE DERIVATIVES AS PHOSPHATIDYLINOSITOL PHOSPHATE KINASE INHIBITORS Ravenna Pharmaceuticals, Inc. (US) 2020-10-28 EP disclosed
US-20200331913-A1 ARYL-BIPYRIDINE AMINE DERIVATIVES AS PHOSPHATIDYLINOSITOL PHOSPHATE KINASE INHIBITORS HIBERCELL, INC. 2020-10-22 US disclosed
US-20200331913-A1 ARYL-BIPYRIDINE AMINE DERIVATIVES AS PHOSPHATIDYLINOSITOL PHOSPHATE KINASE INHIBITORS HIBERCELL, INC. 2020-10-22 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 (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-20200331913-A1 ARYL-BIPYRIDINE AMINE DERIVATIVES AS PHOSPHATIDYLINOSITOL PHOSPHATE KINASE INHIBITORS PIP5K1A, PIP5K1B, PIP5K1C MAP4K1 69/4885CYP3A4 1417/4885ABL1 235/4885
US-11919902-B2 Aryl-bipyridine amine derivatives as phosphatidylinositol phosphate kinase inhibitors PIP5K1A, PIP5K1B, PIP5K1C MAP4K1 69/4885CYP3A4 1417/4885ABL1 235/4885

“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.