SCHEMBL1978785

SCHEMBL1978785

COC(=O)c1cc(C)c(CBr)s1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK2A2 P19784 1/20 0.45
KDR P35968 1/20 0.45
CSNK2B P67870 1/20 0.45
CSNK2A1 P68400 1/20 0.45
HPGD P15428 7/20 0.41
L3MBTL1 Q9Y468 3/20 0.41
MAPK1 P28482 2/20 0.41
NPSR1 Q6W5P4 2/20 0.41
ATM Q13315 2/20 0.41
TSHR P16473 1/20 0.41
KDM4E B2RXH2 7/20 0.40
ALDH1A1 P00352 6/20 0.40
RAB9A P51151 4/20 0.40
NPC1 O15118 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
MAPT P10636 3/20 0.39
DAO P14920 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
OPRD1 P41143 1/20 0.38

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
SCHEMBL27869200 0.87 CSNK2A2 (0.40) CSNK2A2KDRCSNK2BCSNK2A1HPGD
SCHEMBL6919868 0.85 HDAC3 (0.43) HPGDL3MBTL1MAPK1ATMTSHR
SCHEMBL16901555 0.84 HPGD (0.54) CSNK2A2KDRCSNK2BCSNK2A1HPGD
SCHEMBL13545966 0.83 USP2 (0.49) CSNK2A2KDRCSNK2BCSNK2A1HPGD
SCHEMBL23022514 0.81 CSNK2A2 (0.41) CSNK2A2KDRCSNK2BCSNK2A1HPGD
SCHEMBL2063896 0.81 HPGD (0.40) CSNK2A2KDRCSNK2BCSNK2A1HPGD
SCHEMBL7836036 0.79 CYP4A11 (0.44) CSNK2A2KDRCSNK2BCSNK2A1HPGD
SCHEMBL13546197 0.78 KDM4E (0.39) CSNK2A2KDRCSNK2BCSNK2A1HPGD
SCHEMBL7835865 0.78 CSNK2A2 (0.38) CSNK2A2KDRCSNK2BCSNK2A1HPGD
SCHEMBL261464 0.77 CSNK2A2 (0.45) CSNK2A2KDRCSNK2BCSNK2A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2507228-B1 NOVEL SPIROPIPERIDINE COMPOUNDS LILLY CO ELI (US) 2014-11-05 EP disclosed
EP-2507228-B1 NOVEL SPIROPIPERIDINE COMPOUNDS LILLY CO ELI (US) 2014-11-05 EP disclosed
US-8822486-B2 Spiropiperidine compounds ELI LILLY AND COMPANY (US) 2014-09-02 US disclosed
US-8822486-B2 Spiropiperidine compounds ELI LILLY AND COMPANY (US) 2014-09-02 US disclosed
US-8822486-B2 Spiropiperidine compounds ELI LILLY AND COMPANY (US) 2014-09-02 US disclosed
EP-2507228-A1 NOVEL SPIROPIPERIDINE COMPOUNDS Eli Lilly and Company (US) 2012-10-10 EP disclosed
US-20120220616-A1 NOVEL SPIROPIPERIDINE COMPOUNDS ELI LILLY AND COMPANY (US) 2012-08-30 US disclosed
US-20120220616-A1 NOVEL SPIROPIPERIDINE COMPOUNDS ELI LILLY AND COMPANY (US) 2012-08-30 US disclosed
US-20120220616-A1 NOVEL SPIROPIPERIDINE COMPOUNDS ELI LILLY AND COMPANY (US) 2012-08-30 US disclosed
WO-2011066183-A1 NOVEL SPIROPIPERIDINE COMPOUNDS ELI LILLY AND COMPANY (US) 2011-06-03 WO disclosed
WO-2011066183-A1 NOVEL SPIROPIPERIDINE COMPOUNDS ELI LILLY AND COMPANY (US) 2011-06-03 WO 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-20120220616-A1 NOVEL SPIROPIPERIDINE COMPOUNDS REN, SLC5A1, SLC5A2 CSNK2A2 1091/4885KDR 3338/4885CSNK2B 1011/4885

“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.