SCHEMBL1111336

SCHEMBL1111336

CC(F)(F)c1cccc(C=O)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.45
NFE2L2 Q16236 1/20 0.43
UNG P13051 1/20 0.41
FBP1 P09467 1/20 0.41
CYP2A6 P11509 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.38
POLB P06746 1/20 0.38
TAS1R3 Q7RTX0 1/20 0.38
TAS1R1 Q7RTX1 1/20 0.38
SRC P12931 1/20 0.37
ACHE P22303 1/20 0.37
TTR P02766 1/20 0.36
PIM1 P11309 1/20 0.36
CISD1 Q9NZ45 1/20 0.36
PIM2 Q9P1W9 1/20 0.36
P4HB P07237 1/20 0.36
MEN1 O00255 1/20 0.36
LMNA P02545 1/20 0.36
HSP90AA1 P07900 1/20 0.36
MAPT P10636 1/20 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
SCHEMBL15678985 0.85 ALDH1A1 (0.50) ALDH1A1L3MBTL1POLBSRCTTR
SCHEMBL3649236 0.85 ALDH1A1 (0.42) ALDH1A1NFE2L2UNGFBP1CYP2A6
SCHEMBL6854130 0.83 ALDH1A1 (0.48) ALDH1A1NFE2L2UNGFBP1CYP2A6
SCHEMBL29425705 0.83 FBP1 (0.56) ALDH1A1NFE2L2FBP1L3MBTL1POLB
SCHEMBL67201 0.83 FBP1 (0.56) ALDH1A1NFE2L2FBP1L3MBTL1POLB
SCHEMBL6848985 0.83 ALDH1A1 (0.48) ALDH1A1NFE2L2UNGFBP1CYP2A6
SCHEMBL309484 0.83 ALDH1A1 (0.48) ALDH1A1NFE2L2UNGCYP2A6L3MBTL1
SCHEMBL29846591 0.83 ALDH1A1 (0.48) ALDH1A1NFE2L2UNGCYP2A6L3MBTL1
Acetaldehyde SCHEMBL28151033 0.82 NFE2L2 (0.54) ALDH1A1NFE2L2FBP1L3MBTL1POLB
SCHEMBL6855120 0.82 ALDH1A1 (0.47) ALDH1A1NFE2L2UNGFBP1CYP2A6

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 40 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025264844-A1 HETEROCYCLIC GPR52 MODULATORS AND METHODS OF USE THEREOF LIEBER INSTITUTE, INC. (US) 2025-12-26 WO disclosed
WO-2022156792-A1 HETEROCYCLIC COMPOUNDS AS SOS1 INHIBITORS GUANGDONG NEWOPP BIOPHARMACEUTICALS CO., LTD. (CN) 2022-07-28 WO disclosed
US-8426448-B2 1,5-diphenyl-pyrrolidin-2-one compounds as CB-1 ligands ELI LILLY AND COMPANY (US) 2013-04-23 US disclosed
US-8426448-B2 1,5-diphenyl-pyrrolidin-2-one compounds as CB-1 ligands ELI LILLY AND COMPANY (US) 2013-04-23 US disclosed
US-8426448-B2 1,5-diphenyl-pyrrolidin-2-one compounds as CB-1 ligands ELI LILLY AND COMPANY (US) 2013-04-23 US disclosed
US-8299267-B2 (3-hydroxy-4-amino-butan-2-yl) -3- (2-thiazol-2-yl-pyrrolidine-1-carbonyl) benzamide derivatives and related compounds as beta-secretase inhibitors for treating COMENTIS, INC. (US) 2012-10-30 US disclosed
US-8299267-B2 (3-hydroxy-4-amino-butan-2-yl) -3- (2-thiazol-2-yl-pyrrolidine-1-carbonyl) benzamide derivatives and related compounds as beta-secretase inhibitors for treating COMENTIS, INC. (US) 2012-10-30 US disclosed
US-8299267-B2 (3-hydroxy-4-amino-butan-2-yl) -3- (2-thiazol-2-yl-pyrrolidine-1-carbonyl) benzamide derivatives and related compounds as beta-secretase inhibitors for treating COMENTIS, INC. (US) 2012-10-30 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
WO-2009131814-A2 1,5-DIPHENYL-PYRROLIDIN-2-ONE COMPOUNDS AS CB-1 LIGANDS ELI LILLY AND COMPANY (US) 2009-10-29 WO disclosed
EP-2094684-A2 1,5-DIPHENYL-3-BENZYLAMINO-1,5-DIHYDROPYRROLIDIN 2-ONES AS CB1 RECEPTOR MODULATORS Eli Lilly & Company (US) 2009-09-02 EP disclosed
WO-2009042694-A1 (3-HYDROXY-4-AMINO-BUTAN-2-YL) -3- (2-THIAZOL-2-YL-PYRROLIDINE-1-CARBONYL) BENZAMIDE DERIVATIVES AND RELATED COMPOUNDS AS BETA-SECRETASE INHIBITORS FOR TREATING COMENTIS, INC. (US) 2009-04-02 WO disclosed
WO-2009042694-A1 (3-HYDROXY-4-AMINO-BUTAN-2-YL) -3- (2-THIAZOL-2-YL-PYRROLIDINE-1-CARBONYL) BENZAMIDE DERIVATIVES AND RELATED COMPOUNDS AS BETA-SECRETASE INHIBITORS FOR TREATING COMENTIS, INC. (US) 2009-04-02 WO disclosed
WO-2009024615-A1 AMINOBENZYL-SUBSTITUTED CYCLIC SULFONES USEFUL AS BACE INHIBITORS NOVARTIS AG (CH) 2009-02-26 WO disclosed
US-20090054427-A1 AMINOBENZYL-SUBSTITUTED CYCLIC SULFONES USEFUL AS BACE INHIBITORS BRIARD EMMANUELLE 2009-02-26 US disclosed
WO-2009015369-A2 COMPOUNDS WHICH INHIBIT BETA-SECRETASE ACTIVITY AND METHODS OF USE THEREOF COMENTIS, INC. (US) 2009-01-29 WO disclosed
WO-2009015369-A2 COMPOUNDS WHICH INHIBIT BETA-SECRETASE ACTIVITY AND METHODS OF USE THEREOF COMENTIS, INC. (US) 2009-01-29 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
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 (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-20090054427-A1 AMINOBENZYL-SUBSTITUTED CYCLIC SULFONES USEFUL AS BACE INHIBITORS BACE2, BACE1, APP ALDH1A1 2720/4885NFE2L2 359/4885UNG 830/4885

“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.