SCHEMBL22553909

SCHEMBL22553909

Cc1c[nH]c2nccc(-c3cc(-c4ccc(N5CCCC5=O)cc4)cnc3N)c12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACVR1 Q04771 7/20 0.40
TGFBR1 P36897 6/20 0.40
CCNK O75909 1/20 0.39
CDK12 Q9NYV4 1/20 0.39
TNIK Q9UKE5 2/20 0.38
PKM P14618 1/20 0.38
RIPK2 O43353 2/20 0.38
NOD2 Q9HC29 2/20 0.38
ROCK2 O75116 2/20 0.37
ROCK1 Q13464 2/20 0.37
CDC42BPB Q9Y5S2 2/20 0.37
GAA P10253 1/20 0.37
PRKAB2 O43741 1/20 0.36
PRKAG1 P54619 1/20 0.36
PRKAA2 P54646 1/20 0.36
PRKAA1 Q13131 1/20 0.36
PRKAG3 Q9UGI9 1/20 0.36
PRKAG2 Q9UGJ0 1/20 0.36
PRKAB1 Q9Y478 1/20 0.36
FYN P06241 1/20 0.36

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
SCHEMBL30730780 1.00 ACVR1 (0.40) ACVR1TGFBR1CCNKCDK12TNIK
SCHEMBL30730790 0.93 PKM (0.40) ACVR1TGFBR1CCNKCDK12TNIK
SCHEMBL22554267 0.93 PKM (0.40) ACVR1TGFBR1CCNKCDK12TNIK
SCHEMBL22553851 0.87 ROCK2 (0.41) CCNKCDK12TNIKPKMROCK2
SCHEMBL30730813 0.87 ROCK2 (0.41) CCNKCDK12TNIKPKMROCK2
SCHEMBL22570953 0.80 TGFBR1 (0.39) ACVR1TGFBR1CCNKCDK12RIPK2
SCHEMBL30730821 0.76 CHEK2 (0.54) ACVR1TGFBR1GAAFYN
SCHEMBL22553850 0.76 CHEK2 (0.54) ACVR1TGFBR1GAAFYN
SCHEMBL28560346 0.73 MAP4K4 (0.45) ACVR1TGFBR1PRKAB2PRKAG1PRKAA2
SCHEMBL22554094 0.71 PIP4K2A (0.43) ACVR1TGFBR1TNIKRIPK2GAA

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 ACVR1 3809/4885TGFBR1 3028/4885CCNK 314/4885
US-11919902-B2 Aryl-bipyridine amine derivatives as phosphatidylinositol phosphate kinase inhibitors PIP5K1A, PIP5K1B, PIP5K1C ACVR1 3809/4885TGFBR1 3028/4885CCNK 314/4885

“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.