SCHEMBL3417547

SCHEMBL3417547

CCc1c([O])cccc1C(C)C

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 3/20 0.54
GABRG2 P18507 2/20 0.54
GABRB3 P28472 2/20 0.54
CYP1A2 P05177 3/20 0.43
CYP3A4 P08684 3/20 0.43
HPGD P15428 3/20 0.43
GABRB2 P47870 2/20 0.43
TSHR P16473 2/20 0.43
LMNA P02545 2/20 0.43
FAAH O00519 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
GABRB1 P18505 1/20 0.43
PTGS1 P23219 1/20 0.43
SLC6A2 P23975 1/20 0.43
HTR2C P28335 1/20 0.43
GABRA5 P31644 1/20 0.43
GABRA3 P34903 1/20 0.43
HTR2B P41595 1/20 0.43
GABRA2 P47869 1/20 0.43

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
SCHEMBL18469082 0.86 GABRA1 (0.62) GABRA1GABRG2GABRB3CYP1A2CYP3A4
SCHEMBL9579249 0.83 GABRA1 (0.54) GABRA1GABRG2GABRB3CYP1A2CYP3A4
SCHEMBL9734713 0.78 GABRA1 (0.54) GABRA1GABRG2GABRB3CYP1A2CYP3A4
SCHEMBL14498154 0.77 GABRA1 (0.52) GABRA1GABRG2GABRB3CYP1A2CYP3A4
SCHEMBL22699932 0.77 GABRA1 (0.52) GABRA1GABRG2GABRB3CYP1A2CYP3A4
SCHEMBL23995722 0.77 GABRA1 (0.52) GABRA1GABRG2GABRB3CYP1A2CYP3A4
SCHEMBL16956704 0.77 GABRA1 (0.52) GABRA1GABRG2GABRB3CYP1A2CYP3A4
SCHEMBL14498155 0.77 GABRA1 (0.52) GABRA1GABRG2GABRB3CYP1A2CYP3A4
SCHEMBL23447201 0.77 GABRA1 (0.52) GABRA1GABRG2GABRB3CYP1A2CYP3A4
SCHEMBL16950672 0.77 GABRA1 (0.52) GABRA1GABRG2GABRB3CYP1A2CYP3A4

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
CN-116194552-A Cyclic phosphazene compounds having oxaphosphaphenanthrene-containing ring structure 株式会社伏见制药所 2023-05-30 CN disclosed
US-7767739-B2 Cyanato group-containing cyclic phosphazene compound and method for producing the same FUSHIMI PHARMACEUTICAL CO., LTD. (JP) 2010-08-03 US disclosed
US-20090170983-A1 Cyanato Group-Containing Cyclic Phosphazene Compound and Method for Producing The Same FUSHIMI PHARMACEUTICAL CO., LTD. (JP) 2009-07-02 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-20090170983-A1 Cyanato Group-Containing Cyclic Phosphazene Compound and Method for Producing The Same CENPE, CPNE4, MCM3 GABRA1 4017/4885GABRG2 3304/4885GABRB3 2991/4885

“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.