SCHEMBL24809461

SCHEMBL24809461

COc1nc(C(C)(C)C)cn1C(=O)NCCCC1(C(F)(F)F)CC1

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 9/20 0.33
DRD3 P35462 9/20 0.33
ASAH1 Q13510 3/20 0.33
LMNA P02545 1/20 0.31
TSHR P16473 1/20 0.31
HTT P42858 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
NAMPT P43490 1/20 0.30

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
SCHEMBL23124179 0.94 DRD2 (0.31) DRD2DRD3ASAH1
SCHEMBL23132222 0.87 ASAH1 (0.33) ASAH1
SCHEMBL24809415 0.84 ASAH1 (0.34) ASAH1LMNASMN1; SMN2
SCHEMBL24809756 0.82 ASAH1 (0.36) DRD2DRD3ASAH1LMNATSHR
SCHEMBL24812067 0.80 ASAH1 (0.31) ASAH1
SCHEMBL24809406 0.79 NAMPT (0.36) DRD2DRD3ASAH1NAMPT
SCHEMBL24811087 0.78 NAMPT (0.38) DRD2DRD3ASAH1NAMPT
SCHEMBL24809412 0.78 BRD4 (0.36) ASAH1LMNAHTTNPSR1
SCHEMBL24810592 0.77 ASAH1 (0.33) ASAH1
SCHEMBL24809410 0.75 HPGD (0.38) ASAH1LMNAHTTNPSR1NAMPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220411388-A1 SUBSTITUTED IMIDAZOLE CARBOXAMIDES AND THEIR USE IN THE TREATMENT OF MEDICAL DISORDERS BIAL R&D INVEST S A (PT) 2022-12-29 US disclosed
EP-4031531-A1 SUBSTITUTED IMIDAZOLE CARBOXAMIDES AND THEIR USE IN THE TREATMENT OF MEDICAL DISORDERS Bial-R&D Investments, S.A. (PT) 2022-07-27 EP disclosed
CN-114787135-A Substituted imidazole carboxamides and their use in the treatment of medical disorders 比亚尔R&D投资股份公司 2022-07-22 CN 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-20220411388-A1 SUBSTITUTED IMIDAZOLE CARBOXAMIDES AND THEIR USE IN THE TREATMENT OF MEDICAL DISORDERS GBA1, GAA, CLN6 DRD2 3926/4885DRD3 4484/4885ASAH1 16/4885

“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.