SCHEMBL22554094

SCHEMBL22554094

Cc1ncc(-c2ccncc2)cc1-c1ccc(N2CCCC2=O)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIP4K2A P48426 1/20 0.43
PIP4K2C Q8TBX8 1/20 0.43
F10 P00742 3/20 0.43
PRSS1 P07477 2/20 0.43
PRSS2 P07478 2/20 0.43
PRSS3 P35030 2/20 0.43
ACVR1 Q04771 2/20 0.42
ALDH1A1 P00352 1/20 0.41
RIPK2 O43353 1/20 0.40
BMPR1A P36894 1/20 0.40
TGFBR1 P36897 1/20 0.40
ACVRL1 P37023 1/20 0.40
GAA P10253 1/20 0.40
CHEK2 O96017 1/20 0.40
CYP11B2 P19099 1/20 0.40
AKR1C3 P42330 1/20 0.39
CD38 P28907 1/20 0.39
CCNC P24863 1/20 0.39
CDK8 P49336 1/20 0.39
PRKAB2 O43741 1/20 0.39

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
SCHEMBL30730861 1.00 PIP4K2A (0.43) PIP4K2APIP4K2CF10PRSS1PRSS2
SCHEMBL30730821 0.88 CHEK2 (0.54) ACVR1TGFBR1GAACHEK2CYP11B2
SCHEMBL22553850 0.88 CHEK2 (0.54) ACVR1TGFBR1GAACHEK2CYP11B2
SCHEMBL22553727 0.83 ALDH1A1 (0.48) ALDH1A1GAACYP11B2AKR1C3CD38
SCHEMBL30730791 0.83 ALDH1A1 (0.48) ALDH1A1GAACYP11B2AKR1C3CD38
SCHEMBL31296338 0.83 ALDH1A1 (0.56) ALDH1A1GAAAKR1C3SMN1; SMN2L3MBTL1
SCHEMBL22554213 0.83 ALDH1A1 (0.44) F10PRSS1PRSS2PRSS3ACVR1
SCHEMBL30730814 0.83 ALDH1A1 (0.44) F10PRSS1PRSS2PRSS3ACVR1
SCHEMBL30730832 0.82 MAP4K4 (0.44) PIP4K2APIP4K2CF10PRSS1PRSS2
SCHEMBL22553839 0.81 NPC1 (0.48) PIP4K2APIP4K2CF10PRSS1PRSS2

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 9 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-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-A Aryl-bipyridine amine derivatives as phosphoinositide kinase inhibitors 拉文纳制药公司 2020-12-15 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 4/4885PIP4K2C 9/4885F10 3651/4885
US-11919902-B2 Aryl-bipyridine amine derivatives as phosphatidylinositol phosphate kinase inhibitors PIP5K1A, PIP5K1B, PIP5K1C PIP4K2A 4/4885PIP4K2C 9/4885F10 3651/4885

“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.