SCHEMBL22553977

SCHEMBL22553977

Cn1ncc2c(-c3cncc(-c4ccc(N5CCCC5=O)cc4)c3)cn(CC#N)c(=O)c21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIP4K2A P48426 1/20 0.40
BRD4 O60885 1/20 0.39
BRDT Q58F21 1/20 0.39
CCNC P24863 3/20 0.39
CDK8 P49336 3/20 0.39
ALDH1A1 P00352 3/20 0.34
LMNA P02545 1/20 0.34
TSHR P16473 1/20 0.34
NPC1 O15118 1/20 0.34
SYK P43405 4/20 0.34
PRMT5 O14744 1/20 0.33
WDR77 Q9BQA1 1/20 0.33
F10 P00742 2/20 0.33
PRSS1 P07477 1/20 0.33
PRSS2 P07478 1/20 0.33
PRSS3 P35030 1/20 0.33
CD38 P28907 1/20 0.33
KDR P35968 3/20 0.33
FLT1 P17948 2/20 0.33
FLT4 P35916 2/20 0.33

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
SCHEMBL22553979 0.88 BRD4 (0.48) PIP4K2ABRD4BRDTCCNCCDK8
SCHEMBL22554007 0.83 PIP4K2A (0.38) PIP4K2ABRD4BRDTCCNCCDK8
SCHEMBL22554228 0.78 PIP4K2A (0.44) PIP4K2ABRD4BRDTCCNCCDK8
SCHEMBL30730860 0.77 PIP4K2A (0.46) PIP4K2ACCNCCDK8NPC1SYK
SCHEMBL22553963 0.77 PIP4K2A (0.46) PIP4K2ACCNCCDK8NPC1SYK
SCHEMBL30730829 0.75 PIP4K2A (0.41) PIP4K2ABRD4BRDTCCNCCDK8
SCHEMBL22554263 0.75 PIP4K2A (0.41) PIP4K2ABRD4BRDTCCNCCDK8
SCHEMBL22554295 0.75 BRD4 (0.48) PIP4K2ABRD4BRDTCCNCCDK8
SCHEMBL22553767 0.74 BRD4 (0.46) PIP4K2ABRD4BRDTCCNCCDK8
SCHEMBL30730859 0.74 BRD4 (0.46) PIP4K2ABRD4BRDTCCNCCDK8

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 8 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
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
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 PIP4K2A 4/4885BRD4 309/4885BRDT 786/4885
US-11919902-B2 Aryl-bipyridine amine derivatives as phosphatidylinositol phosphate kinase inhibitors PIP5K1A, PIP5K1B, PIP5K1C PIP4K2A 4/4885BRD4 309/4885BRDT 786/4885

“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.