SCHEMBL22191401

SCHEMBL22191401

Cn1c(=O)[nH]c2ccc(-c3cncc(NCc4ccccc4F)c3)cc21

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 2/20 0.46
▸ MAPT P10636 1/20 0.46
▸ PGR P06401 4/20 0.44
▸ LMNA P02545 2/20 0.40
▸ TP53 P04637 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ BRD4 O60885 1/20 0.39
▸ MAOB P27338 1/20 0.38
▸ GRIN1 Q05586 1/20 0.38
▸ GRIN2B Q13224 1/20 0.38
▸ CDK2 P24941 1/20 0.38
▸ AKT1 P31749 1/20 0.38
▸ DYRK1A Q13627 2/20 0.37
▸ MKNK1 Q9BUB5 1/20 0.37
▸ MKNK2 Q9HBH9 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ CDK7 P50613 1/20 0.37
▸ KDM4E B2RXH2 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
SCHEMBL22191396 0.88 PGR (0.49) GAAMAPTPGRLMNATP53
SCHEMBL22191202 0.86 MAOB (0.47) PGRLMNABRD4MAOBCDK2
SCHEMBL22191402 0.83 GAA (0.67) GAAMAPTLMNATP53AKT1
SCHEMBL22191654 0.79 DYRK1A (0.45) MAPTPGRLMNAMAOBGRIN1
SCHEMBL24137732 0.75 CCNC (0.54) GAAMAPTDYRK1AMKNK1MKNK2
SCHEMBL22191148 0.75 PGR (0.46) PGRLMNASMN1; SMN2BRD4MAOB
SCHEMBL22191707 0.75 PGR (0.52) PGRLMNASMN1; SMN2BRD4MAOB
SCHEMBL22191225 0.75 PGR (0.46) PGRLMNASMN1; SMN2BRD4MAOB
SCHEMBL24137846 0.73 CDK7 (0.52) GAAMAPTCDK2AKT1DYRK1A
SCHEMBL22191137 0.73 PGR (0.50) PGRPOLBMAOBAKT1

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 1320/4885PGR 2255/4885

“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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