SCHEMBL24027853

SCHEMBL24027853

CC1(C(F)(F)c2cccc(Br)c2)CC1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 1/20 0.45
▸ CA2 P00918 1/20 0.45
▸ CA5A P35218 1/20 0.45
▸ CA9 Q16790 1/20 0.45
▸ ALDH1A1 P00352 2/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ SLC6A4 P31645 4/20 0.34
▸ KIF11 P52732 1/20 0.34
▸ KDM1A O60341 2/20 0.33
▸ C1S P09871 1/20 0.32
▸ MTOR P42345 1/20 0.31
▸ CTSL P07711 1/20 0.31
▸ SLC6A3 Q01959 3/20 0.31
▸ SLC6A2 P23975 2/20 0.31
▸ HSD11B1 P28845 1/20 0.31
▸ CCR2 P41597 1/20 0.31
▸ CNR1 P21554 1/20 0.31
▸ CNR2 P34972 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ CHRNA1 P02708 1/20 0.31

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
SCHEMBL24027852 0.79 TSHR (0.55) CA1CA2CA9ALDH1A1MAPK1
SCHEMBL30213082 0.79 TSHR (0.55) CA1CA2CA9ALDH1A1MAPK1
SCHEMBL24027846 0.76 IDH2 (0.43) ALDH1A1SLC6A4SLC6A3LMNA
SCHEMBL14650857 0.72 CA1 (0.53) CA1CA2CA5ACA9ALDH1A1
SCHEMBL29427094 0.72 CA1 (0.53) CA1CA2CA5ACA9ALDH1A1
SCHEMBL625781 0.72 CA1 (0.53) CA1CA2CA5ACA9ALDH1A1
SCHEMBL29824423 0.72 CA1 (0.57) CA1CA2CA5ACA9ALDH1A1
SCHEMBL13623124 0.72 CA1 (0.57) CA1CA2CA5ACA9ALDH1A1
SCHEMBL4661 0.72 CA1 (0.57) CA1CA2CA5ACA9ALDH1A1
SCHEMBL25214857 0.70 LMNA (0.51) ALDH1A1LMNA

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
US-20230174507-A1 IMIDAZOLE 3-OXIDE DERIVATIVE BASED ACSS2 INHIBITORS AND METHODS OF USE THEREOF METABOMED LTD. (IL) 2023-06-08 — — US disclosed
US-20230174507-A1 IMIDAZOLE 3-OXIDE DERIVATIVE BASED ACSS2 INHIBITORS AND METHODS OF USE THEREOF METABOMED LTD. (IL) 2023-06-08 — — US disclosed
US-20230174507-A1 IMIDAZOLE 3-OXIDE DERIVATIVE BASED ACSS2 INHIBITORS AND METHODS OF USE THEREOF METABOMED LTD. (IL) 2023-06-08 — — US disclosed
EP-4149928-A1 IMIDAZOLE 3-OXIDE DERIVATIVE BASED ACSS2 INHIBITORS AND METHODS OF USE THEREOF Metabomed Ltd (IL) 2023-03-22 — — EP disclosed
CN-115697974-A Imidazole 3-oxide derivative based ACSS2 inhibitors and methods of use thereof 美特波米德有限公司 2023-02-03 — — CN disclosed
WO-2021229571-A1 IMIDAZOLE 3-OXIDE DERIVATIVE BASED ACSS2 INHIBITORS AND METHODS OF USE THEREOF METABOMED LTD (IL) 2021-11-18 — — 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-20230174507-A1 IMIDAZOLE 3-OXIDE DERIVATIVE BASED ACSS2 INHIBITORS AND METHODS OF USE THEREOF ACSS2, ADSS2, GLS2 CA1 529/4885CA2 1152/4885CA5A 654/4885

“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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