SCHEMBL22553945

SCHEMBL22553945

Cn1ncc2c(-c3cncc(-c4ccc(N5CCCC5=O)cc4)c3)ccnc21

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PIP4K2A P48426 1/20 0.55
CCNC P24863 2/20 0.40
CDK8 P49336 2/20 0.40
CD38 P28907 1/20 0.39
NPC1 O15118 1/20 0.38
CYP11B2 P19099 3/20 0.37
MAP4K1 Q92918 1/20 0.36
SYK P43405 1/20 0.36
CHEK1 O14757 1/20 0.36
BRD4 O60885 1/20 0.36
BRDT Q58F21 1/20 0.36
DGAT2 Q96PD7 1/20 0.36
IP6K1 Q92551 1/20 0.36
IP6K3 Q96PC2 1/20 0.36
IP6K2 Q9UHH9 1/20 0.36
BRD9 Q9H8M2 1/20 0.35
TBK1 Q9UHD2 1/20 0.35
GAA P10253 1/20 0.35
CYP11B1 P15538 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
SCHEMBL30730807 1.00 PIP4K2A (0.55) PIP4K2ACCNCCDK8CD38NPC1
SCHEMBL22553818 0.86 PIP4K2A (0.40) PIP4K2ACCNCCDK8CD38NPC1
SCHEMBL22554302 0.81 PIP4K2A (0.38) PIP4K2ACCNCCDK8CD38NPC1
SCHEMBL22554234 0.81 CCNC (0.41) PIP4K2ACCNCCDK8CD38NPC1
SCHEMBL22578342 0.80 SYK (0.39) PIP4K2ACCNCCDK8CD38NPC1
SCHEMBL22553754 0.80 BRD4 (0.49) PIP4K2ACCNCCDK8CD38NPC1
SCHEMBL30730860 0.80 PIP4K2A (0.46) PIP4K2ACCNCCDK8CD38NPC1
SCHEMBL22553963 0.80 PIP4K2A (0.46) PIP4K2ACCNCCDK8CD38NPC1
SCHEMBL22553979 0.79 BRD4 (0.48) PIP4K2ACCNCCDK8CD38NPC1
SCHEMBL22553955 0.79 PIM1 (0.42) PIP4K2ACCNCCDK8CD38NPC1

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 10 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
CN-112088157-B Aryl-bipyridylamine derivatives as phosphatidylinositol phosphokinase inhibitors 拉文纳制药公司 2023-12-26 CN claimed
CN-112088157-A Aryl-bipyridine amine derivatives as phosphoinositide kinase inhibitors 拉文纳制药公司 2020-12-15 CN claimed
EP-3728230-A1 ARYL-BIPYRIDINE AMINE DERIVATIVES AS PHOSPHATIDYLINOSITOL PHOSPHATE KINASE INHIBITORS Ravenna Pharmaceuticals, Inc. (US) 2020-10-28 EP 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
CN-112088157-B Aryl-bipyridylamine derivatives as phosphatidylinositol phosphokinase inhibitors 拉文纳制药公司 2023-12-26 CN disclosed
CN-112088157-A Aryl-bipyridine amine derivatives as phosphoinositide kinase inhibitors 拉文纳制药公司 2020-12-15 CN 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 PIP4K2A 4/4885CCNC 2067/4885CDK8 1413/4885
US-11919902-B2 Aryl-bipyridine amine derivatives as phosphatidylinositol phosphate kinase inhibitors PIP5K1A, PIP5K1B, PIP5K1C PIP4K2A 4/4885CCNC 2067/4885CDK8 1413/4885

“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.