SCHEMBL1706449

SCHEMBL1706449

CCCCC(F)(F)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CES2 O00748 3/20 0.54
S1PR2 O95136 1/20 0.45
S1PR4 O95977 1/20 0.45
S1PR1 P21453 1/20 0.45
S1PR3 Q99500 1/20 0.45
FAAH O00519 8/20 0.43
CES1 P23141 5/20 0.41
MEN1 O00255 1/20 0.41
CYP1A2 P05177 1/20 0.41
KMT2A Q03164 1/20 0.41
HSD17B10 Q99714 1/20 0.41
LPAR1 Q92633 1/20 0.39
LPAR3 Q9UBY5 1/20 0.39
AKR1B1 P15121 1/20 0.39
EPHX1 P07099 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
SCHEMBL8218831 0.93 CES2 (0.63) CES2S1PR2S1PR4S1PR1S1PR3
SCHEMBL28151371 0.91 CES2 (0.67) CES2S1PR2S1PR4S1PR1S1PR3
SCHEMBL26293737 0.91 CES2 (0.67) CES2S1PR2S1PR4S1PR1S1PR3
SCHEMBL10623101 0.91 CES2 (0.67) CES2S1PR2S1PR4S1PR1S1PR3
SCHEMBL31190476 0.91 CES2 (0.67) CES2S1PR2S1PR4S1PR1S1PR3
SCHEMBL25802000 0.91 CES2 (0.67) CES2S1PR2S1PR4S1PR1S1PR3
SCHEMBL249345 0.84
SCHEMBL15948817 0.81 CES2 (0.48) CES2S1PR2S1PR4S1PR1S1PR3
SCHEMBL28365282 0.80 FAAH (0.57) CES2FAAHCES1CYP1A2KMT2A
SCHEMBL28405075 0.80 F7 (0.55) CES2FAAHCES1CYP1A2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3913720-B1 ELECTROCHEMICAL DEVICE AND ELECTRONIC DEVICE COMPRISING SAME NINGDE AMPEREX TECHNOLOGY LTD (CN) 2024-09-04 EP claimed
US-12617747-B2 Cannabinoid analogs and methods for their preparation INMED PHARMACEUTICALS INC. (CA) 2026-05-05 US disclosed
EP-4658667-A1 CYCLIC PEPTIDES FOR INHIBITING TNF RECEPTOR 1 ACTIVITY Merck Sharp & Dohme LLC (US) 2025-12-10 EP disclosed
WO-2025072539-A1 AMINO ACID COMPOUNDS WITH NITROGEN LINKERS AND USES THEREOF PLIANT THERAPEUTICS, INC. (US) 2025-04-03 WO disclosed
WO-2024163691-A1 CYCLIC PEPTIDES FOR INHIBITING TNF RECEPTOR 1 ACTIVITY MERCK SHARP & DOHME LLC (US) 2024-08-08 WO disclosed
CN-115668569-A Electrolyte solution, electrochemical device, lithium ion secondary battery, and assembly 大金工业株式会社 2023-01-31 CN disclosed
CN-115668571-A Electrolyte solution, electrochemical device, lithium ion secondary battery, module, and compound 大金工业株式会社 2023-01-31 CN disclosed
US-11534434-B2 Xanomeline derivatives and methods for treating neurological disorders Karuna Therapeutics, Inc. (US) 2022-12-27 US disclosed
US-11480878-B2 Monomers, polymers and photoresist compositions ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2022-10-25 US disclosed
US-20210403408-A1 CANNABINOID ANALOGS AND METHODS FOR THEIR PREPARATION INMED PHARMACEUTICALS INC. (CA) 2021-12-30 US disclosed
CN-105209457-A Pyrrolidine derivatives, pharmaceutical compositions containing them, and their use in therapy ABBVIE DEUTSCHLAND 2015-12-30 CN disclosed
WO-2014140310-A1 PYRROLIDINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, AND THEIR USE IN THERAPY AbbVie Deutschland GmbH & Co. KG (DE) 2014-09-18 WO disclosed
US-20140275087-A1 PYRROLIDINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, AND THEIR USE IN THERAPY AbbVie Deutschland GmbH & Co. KG (DE) 2014-09-18 US disclosed
US-20140275086-A1 PYRROLIDINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, AND THEIR USE IN THERAPY AbbVie Deutschland GmbH & Co. KG (DE) 2014-09-18 US disclosed
EP-2440198-A2 HALOGENATED ALIPHATIC CARBOXYLIC ACIDS, OLIGOMERS AND/OR POLYMERS THEREOF AND THEIR USE IN DEVITALIZING EXTERNAL AND INTERNAL NEOPLASMS Mardi Medicines Ltd. (IL) 2012-04-18 EP disclosed
CN-102241587-A Synthesis method of ethyl 2,2-difluorohexanoate SHANGHAI FLUOROTECH SCIENT CO LTD 2011-11-16 CN disclosed
US-20110052641-A1 HALOGENATED ALIPHATIC CARBOXYLIC ACIDS, OLIGOMERS AND/OR POLYMERS THEREOF AND THEIR USE IN DEVITALIZING EXTERNAL AND INTERNAL NEOPLASMS MARDI MEDICINES LTD. (IL) 2011-03-03 US disclosed
WO-2010143188-A2 HALOGENATED ALIPHATIC CARBOXYLIC ACIDS, OLIGOMERS AND/OR POLYMERS THEREOF AND THEIR USE IN DEVITALIZING EXTERNAL AND INTERNAL NEOPLASMS MARDI MEDICINES LTD. (IL) 2010-12-16 WO disclosed
US-4323547-A INVESTIGATING THE DINETICS OF HEART MUSCLE METABOLISM KERNFORSCHUNGSANLAGE JULICH GMBH (DE) 1982-04-06 US disclosed
US-4076911-A PALLADIUM CYANIDE CATALYST UNION OIL COMPANY OF CALIFORNIA (US) 1978-02-28 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 (7 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-12617747-B2 Cannabinoid analogs and methods for their preparation CNR2, CNR1, FAAH CES2 248/4885S1PR2 479/4885S1PR4 883/4885
US-20140275086-A1 PYRROLIDINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, AND THEIR USE IN THERAPY SLC6A7, GFPT1, SUGT1 CES2 876/4885S1PR2 1463/4885S1PR4 2361/4885
US-11534434-B2 Xanomeline derivatives and methods for treating neurological disorders CHRM1, RXFP3, NPY5R CES2 1335/4885S1PR2 2143/4885S1PR4 2346/4885
US-11480878-B2 Monomers, polymers and photoresist compositions PARG, LCP1, ALG3 CES2 1510/4885S1PR2 3737/4885S1PR4 4009/4885
US-20210403408-A1 CANNABINOID ANALOGS AND METHODS FOR THEIR PREPARATION CNR1, CNR2, ERG28 CES2 162/4885S1PR2 1342/4885S1PR4 1216/4885
US-20140275087-A1 PYRROLIDINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, AND THEIR USE IN THERAPY SLC6A7, GFPT1, SUGT1 CES2 876/4885S1PR2 1463/4885S1PR4 2361/4885
US-20110052641-A1 HALOGENATED ALIPHATIC CARBOXYLIC ACIDS, OLIGOMERS AND/OR POLYMERS THEREOF AND THEIR USE IN DEVITALIZING EXTERNAL AND INTERNAL NEOPLASMS CCR10, PBK, CCR3 CES2 944/4885S1PR2 2698/4885S1PR4 2383/4885

“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.