SCHEMBL619346

SCHEMBL619346

[NH]C(=O)c1c(F)c(F)c(F)c(F)c1F

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.42
CES1 P23141 1/20 0.42
HTT P42858 3/20 0.39
LMNA P02545 1/20 0.36
TP53 P04637 1/20 0.36
MAPK1 P28482 1/20 0.36
GAA P10253 1/20 0.34
PKM P14618 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MAPT P10636 1/20 0.32
TSHR P16473 2/20 0.31
RECQL P46063 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA4 P22748 1/20 0.31
HDAC3 O15379 1/20 0.30
HDAC11 Q96DB2 1/20 0.30
HDAC8 Q9BY41 1/20 0.30
HDAC6 Q9UBN7 1/20 0.30
MEN1 O00255 1/20 0.30

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
SCHEMBL707936 0.85 ESR1 (0.39) CES2CES1HTT
SCHEMBL8175703 0.72 CES2 (0.68) CES2CES1HTTLMNATP53
SCHEMBL661258 0.72 CES2 (0.46) CES2CES1HTTLMNATP53
SCHEMBL29449985 0.69 CES2 (0.43) CES2CES1HTTLMNATP53
SCHEMBL203915 0.69 CES2 (0.43) CES2CES1HTTLMNATP53
SCHEMBL317184 0.69 CES2 (0.43) CES2CES1HTTLMNATP53
SCHEMBL336394 0.69 CES2 (0.43) CES2CES1HTTLMNATP53
SCHEMBL217793 0.69 CES2 (0.43) CES2CES1HTTLMNATP53
SCHEMBL6448128 0.69 CES2 (0.43) CES2CES1HTTLMNATP53
SCHEMBL2219947 0.67 CES2 (0.42) CES2CES1HTTLMNATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2491013-B1 Lithium salts of pentafluorphenyl amide anions, production and use of same PHILIPPS UNIVERSITÄT MARBURG (DE) 2016-01-13 EP claimed
EP-2491013-A1 LITHIUM SALTS OF PENTAFLUOROPHENYLAMIDE ANIONS, PREPARATION THEREOF AND USE THEREOF Philipps-Universität Marburg (DE) 2012-08-29 EP claimed
WO-2011048152-A1 LITHIUM SALTS OF PENTAFLUOROPHENYLAMIDE ANIONS, PREPARATION THEREOF AND USE THEREOF PHILIPPS-UNIVERSITÄT MARBURG (DE) 2011-04-28 WO claimed
EP-2314572-A1 Lithium salts of pentafluorphenyl amide anions, production and use of same PHILIPPS-UNIVERSITÄT MARBURG (DE) 2011-04-27 EP claimed
US-7004979-B2 Dyeing composition comprising at least one diaminopyrazole oxidation base and at least one pyrazolo-azole coupling agent L'OREAL S.A. (FR) 2006-02-28 US claimed
US-20040237220-A1 Dyeing composition comprising a diaminopyrazole-type oxidation base and a pyrazolo-azole coupling agent L'OREAL S.A. (FR) 2004-12-02 US claimed
EP-1432391-A1 DYEING COMPOSITION COMPRISING A DIAMINOPYRAZOLE-TYPE OXIDATION BASE AND A PYRAZOLO-AZOLE COUPLING AGENT L'OREAL (FR) 2004-06-30 EP claimed
EP-0891181-B1 KERATIN FIBRE DYE COMPOSITION CONTAINING PYRAZOLO-AZOLE COMPOUNDS, USE THEREOF AS DYE COUPLERS, AND DYEING METHOD OREAL (FR) 2003-05-14 EP claimed
US-6551360-B2 Pyrazoline-3,5-dione-containing compositions for dyeing keratin fibres; their use in dyeing as couplers; dyeing process VIDAL LAURENT (FR) 2003-04-22 US claimed
WO-2003028686-A1 DYEING COMPOSITION COMPRISING A DIAMINOPYRAZOLE-TYPE OXIDATION BASE AND A PYRAZOLO-AZOLE COUPLING AGENT L'OREAL (FR) 2003-04-10 WO claimed
WO-1997035550-A1 KERATIN FIBRE DYE COMPOSITION CONTAINING PYRAZOLO-PYRIMIDINEOXO COMPOUNDS, USE THEREOF AS DYE COUPLERS, AND DYEING METHODS L'OREAL (FR) 1997-10-02 WO claimed
WO-1997035554-A1 KERATIN FIBRE DYE COMPOSITIONS CONTAINING PYRROLO-AZOLE COMPOUNDS, USE THEREOF AS COUPLERS, AND DYEING METHOD L'OREAL (FR) 1997-10-02 WO claimed
EP-0447920-B1 Silver halide color photographic material FUJI PHOTO FILM CO LTD (JP) 1996-02-07 EP claimed
US-5194369-A Heterocyclic diamides as couplers FUJI PHOTO FILM CO., LTD. (JP) 1993-03-16 US claimed
US-5116990-A MAGENTA DYE-FORMING COUPLER FUJI PHOTO FILM CO., LTD. (JP) 1992-05-26 US claimed
EP-0447920-A1 Silver halide color photographic material FUJI PHOTO FILM CO., LTD. (JP) 1991-09-25 EP claimed
US-4892858-A Heat sensitive transfer materials FUJI PHOTO FILM CO., LTD. (JP) 1990-01-09 US claimed
EP-0170164-B1 SILVER HALIDE COLOR PHOTOGRAPHIC LIGHT-SENSITIVE MATERIAL FUJI PHOTO FILM CO., LTD. (JP) 1988-10-05 EP claimed
US-H122-H PYRAZOLOAZOLE-TYPE MAGENTA COUPLER DISPERSED IN A HIGH-BOILING PHOSPHATE SOLVENT FUJI PHOTO FILM CO., LTD. (JP) 1986-09-02 US claimed
EP-0170164-A2 Silver halide color photographic light-sensitive material FUJI PHOTO FILM CO., LTD. (JP) 1986-02-05 EP claimed

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-20040237220-A1 Dyeing composition comprising a diaminopyrazole-type oxidation base and a pyrazolo-azole coupling agent KRT18, PPOX, NOX5 CES2 4235/4885CES1 4419/4885HTT 3659/4885

“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.