SCHEMBL5596444

SCHEMBL5596444

CC(C)(C)OC(=O)N1CCC(N2CCc3c(Cl)ncc4cccc2c34)C1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 4/20 0.46
PIK3R1 P27986 3/20 0.46
USP30 Q70CQ3 4/20 0.43
SRC P12931 4/20 0.41
EGFR P00533 3/20 0.41
ABL1 P00519 2/20 0.40
ABL2 P42684 2/20 0.40
TNF P01375 2/20 0.40
LITAF Q99732 2/20 0.40
SCN9A Q15858 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
NR3C1 P04150 1/20 0.39
HPGDS O60760 1/20 0.39
BCHE P06276 1/20 0.39
HTR6 P50406 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
SCHEMBL5597042 0.95 HTR6 (0.43) PIK3CAPIK3R1USP30SCN9AHPGDS
SCHEMBL5596814 0.94 MEN1 (0.42) PIK3CAPIK3R1MEN1KMT2ANR3C1
SCHEMBL5596780 0.84 TNF (0.43) PIK3CAPIK3R1USP30SRCEGFR
SCHEMBL5596878 0.82 USP30 (0.47) PIK3CAPIK3R1USP30SRCEGFR
SCHEMBL5596809 0.81 GPR119 (0.42) MEN1KMT2ABCHEHTR6
SCHEMBL5596748 0.79 HTR6 (0.41) USP30TNFLITAFSCN9AHPGDS
SCHEMBL5596329 0.78 MEN1 (0.42) TNFLITAFMEN1KMT2ANR3C1
SCHEMBL5596980 0.77 USP30 (0.42) PIK3CAPIK3R1USP30SCN9AHPGDS
SCHEMBL5596750 0.76 GPR119 (0.44) USP30MEN1KMT2A
SCHEMBL3940077 0.75 USP30 (0.49) USP30SRCEGFR

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 PIK3CA 1188/4885PIK3R1 189/4885USP30 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.