SCHEMBL22191202

SCHEMBL22191202

Cn1c(=O)[nH]c2ccc(-c3cncc(NCc4ccccc4)c3)cc21

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 2/20 0.47
▸ PGR P06401 3/20 0.47
▸ DYRK1A Q13627 2/20 0.46
▸ LMNA P02545 1/20 0.43
▸ KCNH2 Q12809 1/20 0.43
▸ BRD4 O60885 1/20 0.42
▸ EGFR P00533 1/20 0.42
▸ PIK3CA P42336 1/20 0.42
▸ CYP11B2 P19099 1/20 0.41
▸ AKT1 P31749 2/20 0.41
▸ WNT1 P04628 1/20 0.41
▸ CDK2 P24941 3/20 0.40
▸ CDK7 P50613 4/20 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
SCHEMBL22191654 0.93 DYRK1A (0.45) MAOBPGRDYRK1ALMNAKCNH2
SCHEMBL22191707 0.88 PGR (0.52) MAOBPGRLMNAKCNH2BRD4
SCHEMBL22191137 0.87 PGR (0.50) MAOBPGRKCNH2EGFRPIK3CA
SCHEMBL22191544 0.86 PGR (0.46) PGRDYRK1ALMNAKCNH2BRD4
SCHEMBL22191396 0.86 PGR (0.49) MAOBPGRDYRK1ALMNABRD4
SCHEMBL22191401 0.86 GAA (0.46) MAOBPGRDYRK1ALMNABRD4
SCHEMBL22191255 0.84 PGR (0.46) PGRKCNH2CYP11B2AKT1
SCHEMBL22191015 0.84 PGR (0.50) MAOBPGRDYRK1ALMNABRD4
SCHEMBL22191227 0.83 PDE3B (0.47) KCNH2EGFRPIK3CACYP11B2CDK2
SCHEMBL22191233 0.81 PGR (0.46) MAOBPGRDYRK1ALMNABRD4

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 MAOB 1417/4885PGR 2255/4885DYRK1A 481/4885

“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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