SCHEMBL22553793

SCHEMBL22553793

COC(=O)N1Cc2nccc(-c3cncc(-c4ccc(N5CCCC5=O)cc4)c3)c2C1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.41
MAPT P10636 1/20 0.41
NPC1 O15118 2/20 0.40
DGAT2 Q96PD7 1/20 0.38
CYP11B2 P19099 2/20 0.37
HTT P42858 1/20 0.37
ATM Q13315 1/20 0.37
HPGDS O60760 1/20 0.37
TNIK Q9UKE5 3/20 0.36
ALDH1A1 P00352 2/20 0.36
HPGD P15428 2/20 0.36
CYP11B1 P15538 1/20 0.36
F10 P00742 2/20 0.35
CD38 P28907 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
SCHEMBL30731020 1.00 SMN1; SMN2 (0.41) SMN1; SMN2MAPTNPC1DGAT2CYP11B2
SCHEMBL30731000 0.81 MEN1 (0.40) SMN1; SMN2MAPTNPC1CYP11B2HTT
SCHEMBL22554028 0.81 MEN1 (0.40) SMN1; SMN2MAPTNPC1CYP11B2HTT
SCHEMBL30730847 0.76 PIP4K2A (0.40) NPC1CYP11B2HPGDSALDH1A1CYP11B1
SCHEMBL22553771 0.76 PIP4K2A (0.40) NPC1CYP11B2HPGDSALDH1A1CYP11B1
SCHEMBL22553938 0.75 NUDT1 (0.43) SMN1; SMN2MAPTNPC1DGAT2CYP11B2
SCHEMBL30731117 0.75 NUDT1 (0.43) SMN1; SMN2MAPTNPC1DGAT2CYP11B2
SCHEMBL30730826 0.75 NUDT1 (0.43) SMN1; SMN2MAPTNPC1DGAT2CYP11B2
SCHEMBL22553750 0.75 CYP11B2 (0.39) SMN1; SMN2NPC1CYP11B2HTTALDH1A1
SCHEMBL22554276 0.75 DGAT2 (0.40) SMN1; SMN2MAPTNPC1DGAT2CYP11B2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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 SMN1; SMN2 3679/4885MAPT 1003/4885NPC1 1648/4885
US-11919902-B2 Aryl-bipyridine amine derivatives as phosphatidylinositol phosphate kinase inhibitors PIP5K1A, PIP5K1B, PIP5K1C SMN1; SMN2 3679/4885MAPT 1003/4885NPC1 1648/4885

“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.