SCHEMBL11272207

SCHEMBL11272207

COC(=O)c1c(N)c(C)nn1C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.45
HPGD P15428 2/20 0.39
LMNA P02545 2/20 0.39
DAPK3 O43293 2/20 0.38
PRKD3 O94806 2/20 0.38
MAP4K4 O95819 2/20 0.38
PRKACA P17612 2/20 0.38
LTK P29376 2/20 0.38
KDR P35968 2/20 0.38
MAPK8 P45983 2/20 0.38
CSNK1A1 P48729 2/20 0.38
CDK8 P49336 2/20 0.38
CLK2 P49760 2/20 0.38
CDK9 P50750 2/20 0.38
CDK5 Q00535 2/20 0.38
MAP2K1 Q02750 2/20 0.38
ACVR1 Q04771 2/20 0.38
ROCK1 Q13464 2/20 0.38
DYRK1A Q13627 2/20 0.38
CLK4 Q9HAZ1 2/20 0.38

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
SCHEMBL11275010 0.82 ALDH1A1 (0.47) KDM4EHPGDLMNAL3MBTL1MAPK1
SCHEMBL31133143 0.81 NPSR1 (0.43) KDM4EHPGDLMNADAPK3PRKD3
SCHEMBL729060 0.81 L3MBTL1 (0.46) KDM4EHPGDLMNAL3MBTL1KMT2A
SCHEMBL21057401 0.80 CYP1A2 (0.36) KDM4EHPGDDAPK3PRKD3MAP4K4
SCHEMBL25759724 0.79 SMN1; SMN2 (0.50) KDM4ELMNAL3MBTL1KMT2AMEN1
SCHEMBL9194890 0.79 KDM4E (0.42) KDM4EHPGDLMNAL3MBTL1KMT2A
SCHEMBL6996899 0.79 NPSR1 (0.36) KDM4EHPGDDAPK3PRKD3MAP4K4
SCHEMBL6363938 0.79 KDM4E (0.44) KDM4ELMNADAPK3PRKD3MAP4K4
SCHEMBL1095 0.79 PIM3 (0.49) KDM4ELMNADAPK3PRKD3MAP4K4
SCHEMBL24276004 0.78 MAPK1 (0.40) KDM4EHPGDLMNADAPK3PRKD3

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240002380-A1 REV-ERB AGONISTS SAINT LOUIS UNIVERSITY (US) 2024-01-04 US disclosed
EP-4228632-A2 REV-ERB AGONISTS Saint Louis University (US) 2023-08-23 EP disclosed
CN-116635029-A REV-ERB agonists 圣路易斯大学 2023-08-22 CN disclosed
WO-2022093552-A9 REV-ERB AGONISTS Saint Louis Univeristy (US) 2022-06-23 WO disclosed
WO-2022093552-A9 REV-ERB AGONISTS Saint Louis Univeristy (US) 2022-06-23 WO disclosed
WO-2022093552-A2 REV-ERB AGONISTS Saint Louis Univeristy (US) 2022-05-05 WO disclosed
WO-2022093552-A2 REV-ERB AGONISTS Saint Louis Univeristy (US) 2022-05-05 WO disclosed
US-20180201622-A1 Fused Bicyclic Heteroaromatic Derivatives as Kinase Inhibitors KATHOLIEKE UNIVERSITEIT LEUVEN, K.U.LEUVEN R&D (BE) 2018-07-19 US disclosed
US-9969748-B2 Fused bicyclic heteroaromatic derivatives as kinase inhibitors UCB BIOPHARMA SPRL (BE) 2018-05-15 US disclosed
US-20170129905-A1 Fused Bicyclic Heteroaromatic Derivatives as Kinase Inhibitors UCB BIOPHARMA SPRL (BE) 2017-05-11 US disclosed
EP-3157923-A1 FUSED BICYCLIC HETEROAROMATIC DERIVATIVES AS KINASE INHIBITORS UCB Biopharma SPRL (BE) 2017-04-26 EP disclosed
WO-2015193168-A1 FUSED BICYCLIC HETEROAROMATIC DERIVATIVES AS KINASE INHIBITORS UCB BIOPHARMA SPRL (BE) 2015-12-23 WO disclosed
US-4317823-A FOR TREATMENT OF GASTROINTESTINAL DISORDERS BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 1982-03-02 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 (3 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-20180201622-A1 Fused Bicyclic Heteroaromatic Derivatives as Kinase Inhibitors PI4KB, PI4KA, PI4K2B KDM4E 1191/4885HPGD 4029/4885LMNA 4764/4885
US-20240002380-A1 REV-ERB AGONISTS NR1D1, ESRRA, ESRRB KDM4E 1855/4885HPGD 2240/4885LMNA 1829/4885
US-20170129905-A1 Fused Bicyclic Heteroaromatic Derivatives as Kinase Inhibitors PI4KB, PI4KA, PI4K2B KDM4E 1191/4885HPGD 4029/4885LMNA 4764/4885

“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.