SCHEMBL5596780

SCHEMBL5596780

CC(C)(C)OC(=O)N1CCC(N2CCc3cnc(Cl)c4cccc2c34)C1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TNF P01375 3/20 0.43
LITAF Q99732 3/20 0.43
USP30 Q70CQ3 5/20 0.42
PIK3CA P42336 2/20 0.42
SCN9A Q15858 1/20 0.41
EGFR P00533 3/20 0.41
SRC P12931 3/20 0.41
PIK3R1 P27986 1/20 0.41
ABL1 P00519 2/20 0.40
ABL2 P42684 2/20 0.40
PARP1 P09874 1/20 0.40
PARP2 Q9UGN5 1/20 0.40
LMNA P02545 1/20 0.40
TP53 P04637 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
NR3C1 P04150 1/20 0.39

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
SCHEMBL5596748 0.95 HTR6 (0.41) TNFLITAFUSP30SCN9A
SCHEMBL5596329 0.94 MEN1 (0.42) TNFLITAFLMNATP53MEN1
SCHEMBL5596618 0.86 BRD4 (0.42) TNFLITAFUSP30SCN9A
SCHEMBL5597044 0.84 SCN9A (0.42) USP30PIK3CASCN9AEGFRSRC
SCHEMBL5596444 0.84 PIK3CA (0.46) TNFLITAFUSP30PIK3CASCN9A
SCHEMBL5596364 0.83 TNF (0.40) TNFLITAFUSP30PIK3CASCN9A
SCHEMBL5596791 0.82 HPGDS (0.40) TNFLITAFUSP30SCN9A
SCHEMBL5596881 0.82 FPR2 (0.42) USP30SCN9A
SCHEMBL5596878 0.82 USP30 (0.47) USP30PIK3CASCN9AEGFRSRC
SCHEMBL5596624 0.82 FGFR4 (0.41) TNFLITAFUSP30SCN9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1829876-A1 NITROGENEOUS TRICYCLIC COMPOUND Asahi Kasei Pharma Corporation (JP) 2007-09-05 EP disclosed
US-20060247266-A1 Nitrogen-containing tricyclic compounds ASAHI KASEI PHARMA CORPORATION (JP) 2006-11-02 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 (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-20060247266-A1 Nitrogen-containing tricyclic compounds MYO1B, CHRM1, MYL12A TNF 4853/4885LITAF 4141/4885USP30 3669/4885

“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.