SCHEMBL6950367

SCHEMBL6950367

N=c1sc(Cl)cn1CC(=O)O

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.36
▸ MAPT P10636 3/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ DAO P14920 1/20 0.34
▸ CA9 Q16790 1/20 0.34
▸ PTGDR2 Q9Y5Y4 1/20 0.33
▸ KMT2A Q03164 3/20 0.33
▸ ADRA1D P25100 1/20 0.32
▸ GSK3B P49841 1/20 0.32
▸ AKR1A1 P14550 5/20 0.31
▸ AKR1B1 P15121 5/20 0.31
▸ STAT3 P40763 1/20 0.31
▸ LMNA P02545 2/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ ALOX12 P18054 1/20 0.31
▸ RECQL P46063 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ F2 P00734 1/20 0.31

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
Bromide SCHEMBL1668833 0.98 ALDH1A1 (0.35) ALDH1A1MAPTKDM4EPOLBDAO
SCHEMBL24163129 0.79 CSNK2A2 (0.38) ALDH1A1MAPTKDM4EPOLBDAO
SCHEMBL6954689 0.74 KDM4E (0.33) ALDH1A1MAPTKDM4EPOLBPTGDR2
SCHEMBL9517884 0.67 PTGDR2 (0.41) ALDH1A1MAPTKDM4EPOLBCA9
SCHEMBL3886114 0.65 SMN1; SMN2 (0.54) ALDH1A1MAPTKDM4EPOLBKMT2A
Hydrochloric Acid SCHEMBL14119393 0.64 SMN1; SMN2 (0.56) ALDH1A1MAPTKDM4EPOLBKMT2A
Bromide SCHEMBL9517907 0.64 NPC1 (0.55) ALDH1A1MAPTKDM4EPOLBKMT2A
SCHEMBL7478784 0.60 MAPT (0.62) ALDH1A1MAPTKDM4EPOLBCA9
SCHEMBL3409817 0.59 ALDH1A1 (0.40) ALDH1A1MAPTKDM4EPOLBPTGDR2
SCHEMBL13031253 0.59 ALDH1A1 (0.43) ALDH1A1MAPTKDM4EPOLBKMT2A

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8586623-B2 2-oxo-1-pyrrolidine derivatives, processes for preparing them and their uses UCB PHARMA, S.A. (BE) 2013-11-19 — — US disclosed
US-20120196866-A1 2-Oxo-1-Pyrrolidine Derivatives, Processes for Preparing Them and Their Uses UCB PHARMA, S.A. (BE) 2012-08-02 — — US disclosed
US-8183241-B2 2-oxo-1-pyrrolidine derivatives UCB PHARMA, S.A. (BE) 2012-05-22 — — US disclosed
US-8178533-B2 2-oxo-1-pyrrolidine derivatives, processes for preparing them and their uses UCB PHARMA, S.A. (BE) 2012-05-15 — — US disclosed
US-20090312333-A1 2-Oxo-1-Pyrrolidine Derivatives, Processes for Preparing Them and Their Uses UCB PHARMA, S.A. (BE) 2009-12-17 — — US disclosed
US-20090156607-A1 2-OXO-1-PYRROLIDINE DERIVATIVES UCB, S.A. (BE) 2009-06-18 — — 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 (3 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-20090312333-A1 2-Oxo-1-Pyrrolidine Derivatives, Processes for Preparing Them and Their Uses CYP3A4, CYP1B1, CYP2D6 ALDH1A1 560/4885MAPT 2583/4885KDM4E 1184/4885
US-20120196866-A1 2-Oxo-1-Pyrrolidine Derivatives, Processes for Preparing Them and Their Uses CYP3A4, CYP1B1, CYP2D6 ALDH1A1 560/4885MAPT 2583/4885KDM4E 1184/4885
US-20090156607-A1 2-OXO-1-PYRROLIDINE DERIVATIVES OPRD1, PPOX, CYP2D6 ALDH1A1 447/4885MAPT 1512/4885KDM4E 1228/4885

“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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