SCHEMBL2254246

SCHEMBL2254246

CC(=O)NC(C)(C)c1ccc(C(F)(F)F)nc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACACB O00763 5/20 0.42
▸ GAA P10253 1/20 0.41
▸ DGAT2 Q96PD7 1/20 0.41
▸ TRPV4 Q9HBA0 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ HDAC3 O15379 2/20 0.39
▸ HDAC1 Q13547 2/20 0.39
▸ HDAC2 Q92769 2/20 0.39
▸ HDAC6 Q9UBN7 2/20 0.39
▸ KMT2A Q03164 1/20 0.38
▸ HDAC4 P56524 1/20 0.37
▸ OGA O60502 1/20 0.36
▸ IDO1 P14902 1/20 0.36
▸ CYP2C9 P11712 1/20 0.36
▸ SLC22A6 Q4U2R8 1/20 0.36
▸ SLC22A8 Q8TCC7 1/20 0.36
▸ SLC22A12 Q96S37 1/20 0.36
▸ SLC22A11 Q9NSA0 1/20 0.36
▸ SCN8A Q9UQD0 2/20 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
SCHEMBL1851604 0.78 PDE2A (0.48) ACACBHDAC3HDAC1HDAC2HDAC6
SCHEMBL608849 0.78 ACACB (0.44) ACACBGAAOGA
SCHEMBL14808848 0.78 ACACB (0.44) ACACBKDM4EMAPTHDAC3HDAC1
SCHEMBL21016975 0.76 HCAR3 (0.47) ACACBGAAKDM4EMAPTKMT2A
SCHEMBL27254652 0.75 ACACB (0.54) ACACBGAAMAPTHDAC1CYP2C9
SCHEMBL21016981 0.75 ACACB (0.42) ACACBKDM4EMAPTKMT2AOGA
SCHEMBL2253745 0.74 TRPV4 (0.50) GAATRPV4KMT2ACYP2C9SLC22A6
SCHEMBL77362 0.74 TRPV4 (0.54) GAATRPV4KMT2ACYP2C9SLC22A6
SCHEMBL23768156 0.73 HCAR3 (0.51) ACACBKDM4EMAPTKMT2AOGA
SCHEMBL9906890 0.72 KDM4E (0.55) GAAKDM4EMAPTKMT2AIDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2099784-B1 1,5-DIPHENYL-3-PYRIDINYLAMINO-1,5-DIHYDRIOYRROLIDIN-2-ONES AS CB1 RECEPTOR MODULATORS LILLY CO ELI (US) 2012-12-12 — — EP disclosed
EP-2099784-B1 1,5-DIPHENYL-3-PYRIDINYLAMINO-1,5-DIHYDRIOYRROLIDIN-2-ONES AS CB1 RECEPTOR MODULATORS LILLY CO ELI (US) 2012-12-12 — — EP disclosed
US-8168659-B2 1, 5-diphenyl-3-benzylamino-1, 5-dihydropyrrolidin-2-one as CB1 receptor modulators ELI LILLY AND COMPANY (US) 2012-05-01 — — US disclosed
US-8168659-B2 1, 5-diphenyl-3-benzylamino-1, 5-dihydropyrrolidin-2-one as CB1 receptor modulators ELI LILLY AND COMPANY (US) 2012-05-01 — — US disclosed
US-8168659-B2 1, 5-diphenyl-3-benzylamino-1, 5-dihydropyrrolidin-2-one as CB1 receptor modulators ELI LILLY AND COMPANY (US) 2012-05-01 — — US disclosed
US-7998985-B2 1,5-diphenyl-3-pyridinylamino-1,5-dihydropyrrolidin-2-one as CB1 receptor modulator ELI LILLY AND COMPANY (US) 2011-08-16 — — US disclosed
US-7998985-B2 1,5-diphenyl-3-pyridinylamino-1,5-dihydropyrrolidin-2-one as CB1 receptor modulator ELI LILLY AND COMPANY (US) 2011-08-16 — — US disclosed
EP-2094684-B1 1,5-DIPHENYL-3-BENZYLAMINO-1,5-DIHYDROPYRROLIDIN 2-ONES AS CB1 RECEPTOR MODULATORS LILLY CO ELI (US) 2010-12-22 — — EP disclosed
EP-2094684-B1 1,5-DIPHENYL-3-BENZYLAMINO-1,5-DIHYDROPYRROLIDIN 2-ONES AS CB1 RECEPTOR MODULATORS LILLY CO ELI (US) 2010-12-22 — — EP disclosed
US-20100016375-A1 1,5-DIPHENYL-3-PYRIDINYLAMINO-1,5-DIHYDROPYRROLIDIN-2-ONE AS CB1 RECEPTOR MODULATOR ELI LILLY AND COMPANY 2010-01-21 — — US disclosed
US-20100016375-A1 1,5-DIPHENYL-3-PYRIDINYLAMINO-1,5-DIHYDROPYRROLIDIN-2-ONE AS CB1 RECEPTOR MODULATOR ELI LILLY AND COMPANY 2010-01-21 — — US disclosed
US-20090275618-A1 1, 5-DIPHENYL-3-BENZYLAMINO-1, 5-DIHYDROPYRROLIDIN-2-ONE AS CB1 RECEPTOR MODULATORS ELI LILLY AND COMPANY 2009-11-05 — — US disclosed
US-20090275618-A1 1, 5-DIPHENYL-3-BENZYLAMINO-1, 5-DIHYDROPYRROLIDIN-2-ONE AS CB1 RECEPTOR MODULATORS ELI LILLY AND COMPANY 2009-11-05 — — US disclosed
US-20090275618-A1 1, 5-DIPHENYL-3-BENZYLAMINO-1, 5-DIHYDROPYRROLIDIN-2-ONE AS CB1 RECEPTOR MODULATORS ELI LILLY AND COMPANY 2009-11-05 — — US disclosed
WO-2008070305-A2 1, 5-DIPHENYL-3-PYRIDINYLAMINO-1, 5-DIHYDROPYRROLIDIN-2-ONE AS CBL' RECEPTOR MODULATOR ELI LILLY AND COMPANY (US) 2008-06-12 — — WO disclosed
WO-2008070306-A2 1,5-DIPHENYL-3-BENZYLAMIN0-1,5-DIHYDR0PYRR0LIDIN-2-0NE AS CB1 RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 2008-06-12 — — 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 (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-20090275618-A1 1, 5-DIPHENYL-3-BENZYLAMINO-1, 5-DIHYDROPYRROLIDIN-2-ONE AS CB1 RECEPTOR MODULATORS CNR1, CNR2, GPR55 ACACB 2389/4885GAA 3424/4885DGAT2 275/4885
US-20100016375-A1 1,5-DIPHENYL-3-PYRIDINYLAMINO-1,5-DIHYDROPYRROLIDIN-2-ONE AS CB1 RECEPTOR MODULATOR CNR1, CNR2, GPR55 ACACB 2351/4885GAA 3987/4885DGAT2 421/4885

“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.

Send feedback