SCHEMBL6153248

SCHEMBL6153248

COc1cc(OC2CCNCC2)c(Cl)cc1C(N)=O

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ HTR4 Q13639 6/20 0.51
▸ MKNK1 Q9BUB5 1/20 0.46
▸ MKNK2 Q9HBH9 1/20 0.46
▸ HTR3A P46098 1/20 0.43
▸ UTS2R Q9UKP6 1/20 0.43
▸ MAP3K5 Q99683 1/20 0.42
▸ TOP2A P11388 3/20 0.42
▸ ACHE P22303 2/20 0.42
▸ HSP90AB1 P08238 2/20 0.42
▸ PDE4A P27815 1/20 0.41
▸ PDE4B Q07343 1/20 0.41
▸ PDE4C Q08493 1/20 0.41
▸ PDE4D Q08499 1/20 0.41
▸ DRD4 P21917 1/20 0.40
▸ JAK2 O60674 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
SCHEMBL6153894 0.86 PDE4A (0.41) HTR4PDE4APDE4BPDE4CPDE4D
SCHEMBL6153891 0.86 PDE4A (0.41) HTR4PDE4APDE4BPDE4CPDE4D
SCHEMBL3344888 0.83 TOP2A (0.47) HTR4MKNK1MKNK2UTS2RMAP3K5
SCHEMBL6153553 0.81 PDE4B (0.44) HTR4HTR3APDE4APDE4BPDE4C
Trifluoroacetic Acid SCHEMBL6153987 0.80 HTR4 (0.45) HTR4HTR3ADRD4
SCHEMBL6154542 0.80 HTR4 (0.58) HTR4HTR3AACHEPDE4ADRD4
Hydrochloric Acid SCHEMBL6154062 0.79 HTR4 (0.57) HTR4HTR3AACHEPDE4ADRD4
SCHEMBL3876555 0.79 GAA (0.53) —
SCHEMBL5372678 0.77 MKNK1 (0.51) MKNK1MKNK2MAP3K5TOP2AHSP90AB1
SCHEMBL12316430 0.77 PDE4B (0.52) TOP2APDE4APDE4BPDE4CPDE4D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3440052-B1 COMPOUNDS FOR USE IN THE TREATMENT OF CANCER UNIV OF OULU (FI) 2023-10-25 — — EP disclosed
US-20210346322-A1 Compounds for use in the treatment of cancer UNIVERSITY OF OULU (FI) 2021-11-11 — — US disclosed
US-20190105289-A1 Compounds for use in the treatment of cancer UNIVERSITY OF OULU (FI) 2019-04-11 — — US disclosed
EP-3440052-A1 COMPOUNDS FOR USE IN THE TREATMENT OF CANCER University Of Oulu (FI) 2019-02-13 — — EP disclosed
WO-2017174879-A1 COMPOUNDS FOR USE IN THE TREATMENT OF CANCER UNIVERSITY OF OULU (FI) 2017-10-12 — — WO disclosed
US-20050182040-A1 Benzamide derivatives DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2005-08-18 — — US disclosed
EP-1500643-A1 BENZAMIDE DERIVATIVES SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2005-01-26 — — EP 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-20210346322-A1 Compounds for use in the treatment of cancer PARP10, MACROD1, MACROD2 HTR4 1829/4885MKNK1 3984/4885MKNK2 3770/4885
US-20190105289-A1 Compounds for use in the treatment of cancer PARP10, MACROD1, MACROD2 HTR4 1829/4885MKNK1 3984/4885MKNK2 3770/4885
US-20050182040-A1 Benzamide derivatives ROCK1, ROCK2, NHERF1 HTR4 2642/4885MKNK1 2457/4885MKNK2 2644/4885

“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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