SCHEMBL22191675

SCHEMBL22191675

O=c1[nH]c2ccc(-c3cncc(CNc4cccc(Cl)c4)c3)cc2[nH]1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 5/20 0.51
▸ MAPT P10636 3/20 0.51
▸ THRB P10828 2/20 0.51
▸ GRIA1 P42261 3/20 0.47
▸ CACNG8 Q8WXS5 3/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ KDM4E B2RXH2 2/20 0.42
▸ ALDH1A1 P00352 1/20 0.42
▸ PDE3B Q13370 1/20 0.42
▸ PDE3A Q14432 1/20 0.42
▸ DYRK1A Q13627 1/20 0.42
▸ ROCK2 O75116 1/20 0.42
▸ GRK2 P25098 1/20 0.42
▸ CYP11B1 P15538 1/20 0.42
▸ CYP11B2 P19099 1/20 0.42
▸ MEN1 O00255 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ XDH P47989 1/20 0.40
▸ SLC22A12 Q96S37 1/20 0.40

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
SCHEMBL22191810 0.87 THRB (0.53) GAAMAPTTHRBGRIA1CACNG8
SCHEMBL22191140 0.87 PDE3B (0.47) GAAMAPTGRIA1CACNG8KDM4E
SCHEMBL22191602 0.87 GAA (0.48) GAAMAPTTHRBGRIA1CACNG8
SCHEMBL22191367 0.87 GAA (0.46) GAAMAPTTHRBGRIA1CACNG8
SCHEMBL22191381 0.84 GAA (0.47) GAAMAPTGRIA1CACNG8L3MBTL1
SCHEMBL22191362 0.81 GRIA1 (0.51) GAAMAPTGRIA1CACNG8L3MBTL1
SCHEMBL22191419 0.81 MAPT (0.53) GAAMAPTTHRBGRIA1CACNG8
SCHEMBL22191660 0.81 THRB (0.50) GAAMAPTTHRBGRIA1CACNG8
SCHEMBL22191227 0.78 PDE3B (0.47) GAAMAPTGRIA1CACNG8KDM4E
SCHEMBL22191151 0.77 BCL6 (0.48) MAPTGRIA1CACNG8KDM4EALDH1A1

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-3906233-B1 KINASE INHIBITOR COMPOUNDS AND COMPOSITIONS AND METHODS OF USE ICAHN SCHOOL MED MOUNT SINAI (US) 2024-01-31 — — EP disclosed
US-20220162182-A1 KINASE INHIBITOR COMPOUNDS AND COMPOSITIONS AND METHODS OF USE NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2022-05-26 — — US disclosed
US-20220162182-A1 KINASE INHIBITOR COMPOUNDS AND COMPOSITIONS AND METHODS OF USE NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2022-05-26 — — US disclosed
EP-3906233-A1 KINASE INHIBITOR COMPOUNDS AND COMPOSITIONS AND METHODS OF USE Icahn School of Medicine at Mount Sinai (US) 2021-11-10 — — EP disclosed
CN-113508111-A Kinase inhibitor compounds and compositions and methods of use 西奈山伊坎医学院 2021-10-15 — — CN disclosed
WO-2020142485-A1 KINASE INHIBITOR COMPOUNDS AND COMPOSITIONS AND METHODS OF USE ICAHN SCHOOL OF MEDICINE AT MOUNT SINAI (US) 2020-07-09 — — WO 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 (1 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-20220162182-A1 KINASE INHIBITOR COMPOUNDS AND COMPOSITIONS AND METHODS OF USE MAP3K20, MAP3K1, PACSIN2 GAA 829/4885MAPT 1320/4885THRB 408/4885

“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.

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