SCHEMBL22554064

SCHEMBL22554064

CNC(=O)c1cc2c(-c3cncc(-c4ccc(N5CCCC5=O)cc4)c3)cn(C)c2c(=O)n1C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.41
BRD4 O60885 1/20 0.41
BRDT Q58F21 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
CCNC P24863 1/20 0.37
CDK8 P49336 1/20 0.37
CYP11B2 P19099 2/20 0.37
PHGDH O43175 1/20 0.37
GALR3 O60755 1/20 0.36
LMNA P02545 1/20 0.36
TSHR P16473 1/20 0.36
HTT P42858 1/20 0.36
SYK P43405 4/20 0.35
CHEK1 O14757 1/20 0.35
DGAT2 Q96PD7 1/20 0.35
IP6K1 Q92551 1/20 0.35
IP6K3 Q96PC2 1/20 0.35
IP6K2 Q9UHH9 1/20 0.35
SMN1; SMN2 Q16637 2/20 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
SCHEMBL22553848 0.90 BRD4 (0.42) NPC1BRD4BRDTCCNCCDK8
SCHEMBL22553869 0.88 BRD4 (0.41) NPC1BRD4BRDTCCNCCDK8
SCHEMBL22553779 0.81 BRD4 (0.47) NPC1BRD4BRDTCCNCCDK8
SCHEMBL22553934 0.80 NPC1 (0.46) NPC1BRD4BRDTMEN1KMT2A
SCHEMBL22553979 0.77 BRD4 (0.48) NPC1BRD4BRDTCCNCCDK8
SCHEMBL22571017 0.75 CHEK1 (0.38) BRD4CYP11B2HTTCHEK1ALDH1A1
SCHEMBL22554295 0.75 BRD4 (0.48) NPC1BRD4BRDTCCNCCDK8
SCHEMBL22554063 0.74 BRD4 (0.45) NPC1BRD4BRDTCCNCCDK8
SCHEMBL22553754 0.74 BRD4 (0.49) NPC1BRD4BRDTCCNCCDK8
SCHEMBL22553919 0.74 PIP4K2A (0.46) NPC1BRD4BRDTCCNCCDK8

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
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

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 NPC1 1648/4885BRD4 309/4885BRDT 786/4885
US-11919902-B2 Aryl-bipyridine amine derivatives as phosphatidylinositol phosphate kinase inhibitors PIP5K1A, PIP5K1B, PIP5K1C NPC1 1648/4885BRD4 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.