SCHEMBL2298269

SCHEMBL2298269

CC(Cl)OC(=O)N1CCO[C@@H](c2ccc(OS(=O)(=O)c3ccccc3)cc2)C1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 2/20 0.39
TDP1 Q9NUW8 1/20 0.38
MOGAT2 Q3SYC2 1/20 0.38
ADAMTS4 O75173 1/20 0.37
ENPP3 O14638 5/20 0.37
ENPP1 P22413 5/20 0.37
CNR2 P34972 1/20 0.37
ENPP2 Q13822 3/20 0.36
CA2 P00918 1/20 0.35
CA9 Q16790 1/20 0.35
KMT2A Q03164 1/20 0.35
ATM Q13315 1/20 0.35
MAOB P27338 1/20 0.35
NPC1 O15118 1/20 0.34
ALDH1A1 P00352 1/20 0.34
RAB9A P51151 1/20 0.34

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
SCHEMBL2297261 1.00 USP30 (0.39) USP30TDP1MOGAT2ADAMTS4ENPP3
SCHEMBL2294862 0.91 CYP2C9 (0.40) ENPP3ENPP1ENPP2ALDH1A1
SCHEMBL2292876 0.91 CYP2C9 (0.40) ENPP3ENPP1ENPP2ALDH1A1
SCHEMBL2298271 0.88 ENPP3 (0.42) USP30TDP1ADAMTS4ENPP3ENPP1
SCHEMBL2297829 0.88 ENPP3 (0.42) USP30TDP1ADAMTS4ENPP3ENPP1
SCHEMBL2297496 0.87 MOGAT2 (0.37) USP30MOGAT2ENPP3ENPP1CNR2
SCHEMBL2294697 0.87 MOGAT2 (0.37) USP30MOGAT2ENPP3ENPP1CNR2
SCHEMBL2298066 0.86 F2 (0.41) USP30KMT2AALDH1A1
SCHEMBL2299645 0.86 F2 (0.41) USP30KMT2AALDH1A1
SCHEMBL2298229 0.86 KMT2A (0.45) USP30ENPP3ENPP1CNR2ENPP2

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
US-20110257392-A1 INTERMEDIATE COMPOUND FOR SYNTHESIZING PHARMACEUTICAL AGENT AND PRODUCTION METHOD THEREOF SANOFI-AVENTIS (FR) 2011-10-20 US disclosed
US-20110251385-A1 INTERMEDIATE COMPOUND FOR SYNTHESIZING PHARMACEUTICAL AGENT AND PRODUCTION METHOD THEREOF SANOFI-AVENTIS (FR) 2011-10-13 US disclosed
US-7994315-B2 Intermediate compound for synthesizing pharmaceutical agent and production method thereof MITSUBISHI TANABE PHARMA CORPORATION (JP) 2011-08-09 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-20110257392-A1 INTERMEDIATE COMPOUND FOR SYNTHESIZING PHARMACEUTICAL AGENT AND PRODUCTION METHOD THEREOF MAPT, PSEN1, PSEN2 USP30 3057/4885TDP1 659/4885MOGAT2 2303/4885
US-20110251385-A1 INTERMEDIATE COMPOUND FOR SYNTHESIZING PHARMACEUTICAL AGENT AND PRODUCTION METHOD THEREOF MAPT, PSEN1, PSEN2 USP30 3057/4885TDP1 659/4885MOGAT2 2303/4885

“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.