SCHEMBL5596601

SCHEMBL5596601

CC(C)(C)OC(=O)N1CCC(N2CCc3cncc4ccc(Br)c2c34)C1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 6/20 0.42
PIK3CA P42336 2/20 0.41
PIK3R1 P27986 1/20 0.41
SRC P12931 3/20 0.38
FPR2 P25090 3/20 0.38
EGFR P00533 1/20 0.38
GPR119 Q8TDV5 2/20 0.37
TP53 P04637 1/20 0.36
HDAC4 P56524 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
PIK3CD O00329 1/20 0.36

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
SCHEMBL5597012 0.95 FPR2 (0.44) USP30PIK3CAPIK3R1FPR2HDAC4
SCHEMBL5597056 0.94 TP53 (0.41) FPR2GPR119TP53
SCHEMBL5596812 0.89 PIK3CA (0.45) USP30PIK3CAPIK3R1SRCEGFR
SCHEMBL5597039 0.84 FPR2 (0.41) USP30PIK3CAPIK3R1SRCFPR2
SCHEMBL5596990 0.83 USP30 (0.40) USP30PIK3CAPIK3R1SRCFPR2
SCHEMBL5596448 0.83 TP53 (0.41) PIK3CAPIK3R1SRCEGFRGPR119
SCHEMBL5596878 0.83 USP30 (0.47) USP30PIK3CAPIK3R1SRCEGFR
SCHEMBL5597227 0.81 USP30 (0.42) USP30PIK3CAPIK3R1SRCFPR2
SCHEMBL5596649 0.81 FPR2 (0.43) FPR2GPR119
SCHEMBL5596376 0.78 FPR2 (0.44) USP30PIK3CAPIK3R1FPR2HDAC4

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 USP30 3669/4885PIK3CA 1188/4885PIK3R1 189/4885

“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.