SCHEMBL6352947

SCHEMBL6352947

CC(C)(C)OC(=O)N1CCC=C(c2ccccc2)C1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.49
PDK4 Q16654 1/20 0.48
NAMPT P43490 1/20 0.47
GPR119 Q8TDV5 1/20 0.47
ESR2 Q92731 1/20 0.47
RORC P51449 1/20 0.47
CKS1B P61024 2/20 0.46
SKP1 P63208 2/20 0.46
SKP2 Q13309 2/20 0.46
NR1H2 P55055 1/20 0.46
GRM5 P41594 1/20 0.46
GRM1 Q13255 1/20 0.46
USP30 Q70CQ3 4/20 0.45
UCHL1 P09936 1/20 0.43
KDM4E B2RXH2 1/20 0.43
PKM P14618 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
SCHEMBL22944628 0.97 NAMPT (0.48) MAPK1PDK4NAMPTGPR119ESR2
SCHEMBL22945388 0.91 USP30 (0.48) MAPK1PDK4GPR119ESR2RORC
SCHEMBL22944329 0.90 TNK2 (0.49) MAPK1PDK4NAMPTGPR119ESR2
SCHEMBL29197658 0.88 ESR2 (0.55) MAPK1PDK4NAMPTGPR119ESR2
SCHEMBL21425203 0.87 MAPK1 (0.41) MAPK1PDK4GPR119ESR2RORC
SCHEMBL28835616 0.86 NR1H2 (0.56) MAPK1PDK4NAMPTGPR119ESR2
SCHEMBL22441484 0.86 GRM1 (0.48) MAPK1PDK4NAMPTGPR119ESR2
SCHEMBL22945237 0.86 MEN1 (0.51) MAPK1PDK4NAMPTESR2NR1H2
SCHEMBL19459096 0.86 ESR2 (0.45) MAPK1PDK4NAMPTESR2RORC
SCHEMBL14262836 0.86 PDK4 (0.56) MAPK1PDK4NAMPTGPR119CKS1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9073856-B2 Phenyl methanesulfonamide derivatives useful as MGAT-2 inhibitors ELI LILLY AND COMPANY (US) 2015-07-07 US disclosed
US-20140371269-A1 PHENYL METHANESULFONAMIDE DERIVATIVES USEFUL AS MGAT-2 INHIBITORS ELI LILLY AND COMPANY (US) 2014-12-18 US disclosed
EP-2807147-A1 PHENYL METHANESULFONAMIDE DERIVATIVES USEFUL AS MGAT - 2 INHIBITORS Eli Lilly and Company (US) 2014-12-03 EP disclosed
WO-2013112323-A1 PHENYL METHANESULFONAMIDE DERIVATIVES USEFUL AS MGAT - 2 INHIBITORS ELI LILLY AND COMPANY (US) 2013-08-01 WO disclosed
US-20050176727-A1 Oximes and hydrazones that are useful in treating sexual dysfunction ABBOTT LABORATORIES 2005-08-11 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-20050176727-A1 Oximes and hydrazones that are useful in treating sexual dysfunction CYP19A1, SHBG, CYP17A1 MAPK1 1886/4885PDK4 824/4885NAMPT 2899/4885
US-20140371269-A1 PHENYL METHANESULFONAMIDE DERIVATIVES USEFUL AS MGAT-2 INHIBITORS MGST1, MGAT1, MGAT2 MAPK1 1387/4885PDK4 1069/4885NAMPT 500/4885

“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.