SCHEMBL22554043

SCHEMBL22554043

CN(C)C(=O)c1cnc2[nH]cc(-c3cncc(-c4ccc(N5CCCC5=O)cc4)c3)c2c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP4K1 Q92918 3/20 0.48
ABL1 P00519 2/20 0.48
TNIK Q9UKE5 1/20 0.47
CYP11B2 P19099 1/20 0.45
NPC1 O15118 1/20 0.42
CLK1 P49759 3/20 0.41
DYRK1A Q13627 3/20 0.41
AXL P30530 3/20 0.41
SGK1 O00141 3/20 0.41
CAMKK2 Q96RR4 2/20 0.41
MAP3K11 Q16584 1/20 0.40
DYRK1B Q9Y463 2/20 0.40
PRKAB2 O43741 1/20 0.40
PRKAG1 P54619 1/20 0.40
PRKAA2 P54646 1/20 0.40
PRKAA1 Q13131 1/20 0.40
PRKAG3 Q9UGI9 1/20 0.40
PRKAG2 Q9UGJ0 1/20 0.40
PRKAB1 Q9Y478 1/20 0.40
IP6K1 Q92551 1/20 0.39

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
SCHEMBL22553926 0.89 ROCK2 (0.47) TNIKCYP11B2NPC1CLK1DYRK1A
SCHEMBL22553799 0.85 CD38 (0.42) MAP4K1NPC1CLK1DYRK1AAXL
SCHEMBL22553766 0.84 CYP11B2 (0.44) MAP4K1TNIKCYP11B2NPC1IP6K1
SCHEMBL22554249 0.83 CYP11B2 (0.45) CYP11B2NPC1CAMKK2PRKAB2PRKAG1
SCHEMBL22553785 0.83 CYP11B2 (0.45) CYP11B2NPC1PRKAB2PRKAG1PRKAA2
SCHEMBL22553730 0.83 DYRK1A (0.40) MAP4K1TNIKNPC1CLK1DYRK1A
SCHEMBL22553811 0.83 JAK2 (0.46) MAP4K1TNIKNPC1CLK1DYRK1A
SCHEMBL22553722 0.82 MAP4K1 (0.40) MAP4K1NPC1CLK1DYRK1AAXL
SCHEMBL22570987 0.82 DYRK1A (0.39) CYP11B2NPC1CLK1DYRK1AAXL
SCHEMBL30730843 0.81 CYP11B2 (0.42) CYP11B2NPC1IP6K1IP6K3IP6K2

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 5 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 claimed
US-20200331913-A1 ARYL-BIPYRIDINE AMINE DERIVATIVES AS PHOSPHATIDYLINOSITOL PHOSPHATE KINASE INHIBITORS HIBERCELL, INC. 2020-10-22 US claimed
US-11919902-B2 Aryl-bipyridine amine derivatives as phosphatidylinositol phosphate kinase inhibitors HIBERCELL, INC. (US) 2024-03-05 US 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 69/4885ABL1 235/4885TNIK 212/4885
US-11919902-B2 Aryl-bipyridine amine derivatives as phosphatidylinositol phosphate kinase inhibitors PIP5K1A, PIP5K1B, PIP5K1C MAP4K1 69/4885ABL1 235/4885TNIK 212/4885

“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.