SCHEMBL6245012

SCHEMBL6245012

O=C(O)C1NCCc2c1[nH]c1ccc(Cl)cc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAPKAPK2 P49137 9/20 1.00
SIRT1 Q96EB6 1/20 0.79
MAPKAPK5 Q8IW41 1/20 0.68
HTR2C P28335 9/20 0.63
HTR2A P28223 9/20 0.63
HTR2B P41595 2/20 0.60

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
Hydrochloric Acid SCHEMBL6422114 0.99 MAPKAPK2 (0.97) MAPKAPK2SIRT1MAPKAPK5HTR2CHTR2A
SCHEMBL6240174 0.85 MAPKAPK2 (1.00) MAPKAPK2SIRT1MAPKAPK5HTR2CHTR2A
Hydrochloric Acid SCHEMBL6236292 0.84 MAPKAPK2 (0.97) MAPKAPK2MAPKAPK5HTR2CHTR2A
SCHEMBL6238971 0.84 MAPKAPK2 (0.74) MAPKAPK2SIRT1MAPKAPK5HTR2CHTR2A
SCHEMBL6240455 0.84 MAPKAPK2 (1.00) MAPKAPK2SIRT1MAPKAPK5HTR2CHTR2A
SCHEMBL6239981 0.84 MAPKAPK2 (0.74) MAPKAPK2SIRT1MAPKAPK5HTR2CHTR2A
SCHEMBL21723836 0.83 MAPKAPK2 (0.71) MAPKAPK2SIRT1HTR2CHTR2AHTR2B
Hydrochloric Acid SCHEMBL6360792 0.83 MAPKAPK2 (0.73) MAPKAPK2SIRT1MAPKAPK5HTR2CHTR2A
SCHEMBL6241494 0.83 MAPKAPK2 (0.83) MAPKAPK2SIRT1MAPKAPK5
SCHEMBL23070186 0.82 MAPKAPK2 (0.69) MAPKAPK2SIRT1MAPKAPK5HTR2CHTR2A

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-12371429-B2 Antibiotic resistance-modifying tricyclic heteroaryl compounds and uses thereof RECREO PHARMACEUTICALS LLC (US) 2025-07-29 US disclosed
EP-3836919-A1 1,3,4,9-TETRAHYDRO-2H-PYRIDO[3,4-B]INDOLE DERIVATIVE COMPOUNDS AND USES THEREOF Recreo Pharmaceuticals Inc. (US) 2021-06-23 EP disclosed
US-20210163479-A1 1,3,4,9-TETRAHYDRO-2H-PYRIDO[3,4-B]INDOLE DERIVATIVE COMPOUNDS AND USES THEREOF RECREO PHARMACEUTICALS LLC (US) 2021-06-03 US disclosed
US-20210163479-A1 1,3,4,9-TETRAHYDRO-2H-PYRIDO[3,4-B]INDOLE DERIVATIVE COMPOUNDS AND USES THEREOF RECREO PHARMACEUTICALS LLC (US) 2021-06-03 US disclosed
CN-112654354-A 1,3,4, 9-tetrahydro-2H-pyrido [3,4-b ] indole derivative compound and application thereof 菲尼克思药业股份有限公司 2021-04-13 CN disclosed
WO-2020037155-A1 1,3,4,9-TETRAHYDRO-2H-PYRIDO[3,4-B]INDOLE DERIVATIVE COMPOUNDS AND USES THEREOF RECREO PHARMACEUTICALS LLC (US) 2020-02-20 WO disclosed
WO-2020037155-A1 1,3,4,9-TETRAHYDRO-2H-PYRIDO[3,4-B]INDOLE DERIVATIVE COMPOUNDS AND USES THEREOF RECREO PHARMACEUTICALS LLC (US) 2020-02-20 WO disclosed
US-20050137220-A1 Beta-carboline compounds and analogues thereof as mitogen-activated protein kinase-activated protein kinase-2 inhibitors PHARMACIA CORPORATION (US) 2005-06-23 US disclosed
WO-2005009370-A2 BETA-CARBOLINE COMPOUNDS AND ANALOGUES THEREOF AND THEIR USE AS MITOGEN-ACTIVATED PROTEIN KINASE-ACTIVATED PROTEIN KINASE-2 INHIBITORS PHARMACIA CORPORATION (US) 2005-02-03 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 (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-12371429-B2 Antibiotic resistance-modifying tricyclic heteroaryl compounds and uses thereof CBR3, CBR1, CYP2B6 MAPKAPK2 4867/4885SIRT1 1108/4885MAPKAPK5 4874/4885
US-20050137220-A1 Beta-carboline compounds and analogues thereof as mitogen-activated protein kinase-activated protein kinase-2 inhibitors MAPKAPK2, MAP4K2, MAP3K2 MAPKAPK2 1/4885SIRT1 1037/4885MAPKAPK5 34/4885
US-20210163479-A1 1,3,4,9-TETRAHYDRO-2H-PYRIDO[3,4-B]INDOLE DERIVATIVE COMPOUNDS AND USES THEREOF H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, CCNA1, FOXM1 MAPKAPK2 4797/4885SIRT1 1081/4885MAPKAPK5 4875/4885

“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.