SCHEMBL19852976

SCHEMBL19852976

CC1CC12CCCN(C(=O)OC(C)(C)C)C2

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 1/20 0.46
▸ EPHX2 P34913 1/20 0.42
▸ USP2 O75604 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ EPHX1 P07099 1/20 0.40
▸ MAPT P10636 2/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ THRB P10828 1/20 0.40
▸ MEN1 O00255 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ PREP P48147 2/20 0.39
▸ RECQL P46063 1/20 0.38
▸ NR1H2 P55055 1/20 0.37
▸ GRIN2B Q13224 1/20 0.37
▸ GRIN2C Q14957 1/20 0.37
▸ GPR119 Q8TDV5 1/20 0.36
▸ CYP11B2 P19099 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
SCHEMBL16984145 1.00 HPGD (0.46) HPGDEPHX2USP2SMN1; SMN2EPHX1
SCHEMBL16984366 0.91 USP2 (0.44) HPGDEPHX2USP2SMN1; SMN2EPHX1
SCHEMBL16984335 0.88 HPGD (0.49) HPGDEPHX2USP2SMN1; SMN2EPHX1
SCHEMBL17960132 0.84 HPGD (0.43) HPGDEPHX2USP2SMN1; SMN2EPHX1
SCHEMBL16984292 0.84 USP2 (0.44) HPGDEPHX2USP2SMN1; SMN2EPHX1
SCHEMBL16984973 0.83 HPGD (0.42) HPGDEPHX2USP2SMN1; SMN2EPHX1
SCHEMBL29753550 0.83 NR1H2 (0.43) HPGDEPHX2USP2SMN1; SMN2EPHX1
SCHEMBL29753653 0.83 HPGD (0.42) HPGDEPHX2USP2SMN1; SMN2EPHX1
SCHEMBL29753130 0.82 HPGD (0.44) HPGDEPHX2USP2SMN1; SMN2EPHX1
SCHEMBL16042188 0.81 HPGD (0.46) HPGDEPHX2USP2SMN1; SMN2EPHX1

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
US-10196399-B2 Metabotrophic glutamate receptor 5 modulators and methods use thereof SUNOVION PHARMACEUTICALS INC. (US) 2019-02-05 — — US disclosed
US-20180037585-A1 METABOTROPHIC GLUTAMATE RECEPTOR 5 MODULATORS AND METHODS USE THEREOF SUNOVION PHARAMCEUTICALS INC. 2018-02-08 — — 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 (2 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-10196399-B2 Metabotrophic glutamate receptor 5 modulators and methods use thereof GRM5, GRIK5, GRM2 HPGD 1309/4885EPHX2 2551/4885USP2 2596/4885
US-20180037585-A1 METABOTROPHIC GLUTAMATE RECEPTOR 5 MODULATORS AND METHODS USE THEREOF GRM5, GRIK5, GRM2 HPGD 1309/4885EPHX2 2551/4885USP2 2596/4885

“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.

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