SCHEMBL6330197

SCHEMBL6330197

C[C@@H](CC(=O)O)c1ccc(F)cc1

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 5/20 0.59
POLB P06746 1/20 0.51
ACHE P22303 1/20 0.46
ALDH1A1 P00352 2/20 0.45
KDM4E B2RXH2 1/20 0.45
HTT P42858 1/20 0.45
FFAR4 Q5NUL3 1/20 0.44
NPSR1 Q6W5P4 1/20 0.43
HPGD P15428 2/20 0.42
TSHR P16473 1/20 0.42
STAT3 P40763 1/20 0.42
MME P08473 1/20 0.42

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
SCHEMBL3885400 1.00 FFAR1 (0.59) FFAR1POLBACHEALDH1A1KDM4E
SCHEMBL16232153 1.00 FFAR1 (0.59) FFAR1POLBACHEALDH1A1KDM4E
SCHEMBL11488269 0.94 FFAR1 (0.60) FFAR1POLBACHEMME
Azetidine SCHEMBL28221759 0.90 FFAR1 (0.50) FFAR1POLBACHEALDH1A1KDM4E
SCHEMBL11332403 0.83 FFAR1 (0.62) FFAR1POLBACHEALDH1A1KDM4E
SCHEMBL7565865 0.82 POLB (0.47) FFAR1POLBACHEALDH1A1KDM4E
SCHEMBL16232164 0.82 POLB (0.47) FFAR1POLBACHEALDH1A1KDM4E
SCHEMBL16232165 0.82 POLB (0.47) FFAR1POLBACHEALDH1A1KDM4E
SCHEMBL12883179 0.82 POLB (0.47) FFAR1POLBACHEALDH1A1KDM4E
SCHEMBL28770128 0.82 POLB (0.47) FFAR1POLBACHEALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11634396-B2 Opioid receptor modulators EPIODYNE, INC. (US) 2023-04-25 US disclosed
US-9914702-B2 Amine derivatives as potassium channel blockers BIONOMICS LIMITED (AU) 2018-03-13 US disclosed
US-20170088519-A1 AMINE DERIVATIVES AS POTASSIUM CHANNEL BLOCKERS BIONOMICS, LTD (AU) 2017-03-30 US disclosed
US-20170088519-A1 AMINE DERIVATIVES AS POTASSIUM CHANNEL BLOCKERS BIONOMICS, LTD (AU) 2017-03-30 US disclosed
US-9493451-B2 Amine derivatives as potassium channel blockers BIONOMICS LIMITED (AU) 2016-11-15 US disclosed
US-9493451-B2 Amine derivatives as potassium channel blockers BIONOMICS LIMITED (AU) 2016-11-15 US disclosed
US-20150299184-A1 Amine Derivatives as Potassium Channel Blockers BIONOMICS LIMITED (AU) 2015-10-22 US disclosed
US-20150299184-A1 Amine Derivatives as Potassium Channel Blockers BIONOMICS LIMITED (AU) 2015-10-22 US disclosed
US-20140336198-A1 Amine Derivatives as Potassium Channel Blockers MERCK PATENT GMBH (DE) 2014-11-13 US disclosed
US-20140336198-A1 Amine Derivatives as Potassium Channel Blockers MERCK PATENT GMBH (DE) 2014-11-13 US disclosed
US-6858611-B2 Potassium channel inhibitors ICAGEN, INC. (US) 2005-02-22 US disclosed
US-20030236261-A1 Potassium channel inhibitors ICAGEN, INC. (US) 2003-12-25 US disclosed
US-6566380-B2 For therapy of cardiac arrhythmias ICAGEN, INC. 2003-05-20 US disclosed
EP-1305288-A1 POTASSIUM CHANNEL INHIBITORS Icagen, Inc. (US) 2003-05-02 EP disclosed
US-20030027829-A1 Amide substituted heteroaromatic bicylcyclic or tetrahydronaphthalene sulfonamide compounds are useful for treating arrhythmia ICAGEN, INC. 2003-02-06 US disclosed
WO-2002008191-A1 POTASSIUM CHANNEL INHIBITORS ICAGEN, INC. (US) 2002-01-31 WO disclosed
CN-1314906-A Salts of paroxetine SMITHKLINE BEECHAM PLC (GB) 2001-09-26 CN disclosed
EP-1091958-A1 SALTS OF PAROXETINE SMITHKLINE BEECHAM PLC (GB) 2001-04-18 EP disclosed
WO-2000001692-A1 SALTS OF PAROXETINE SMITHKLINE BEECHAM PLC (GB) 2000-01-13 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 (6 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-20170088519-A1 AMINE DERIVATIVES AS POTASSIUM CHANNEL BLOCKERS KCNA3, KCNH3, KCNK3 FFAR1 2942/4885POLB 3795/4885ACHE 712/4885
US-20030236261-A1 Potassium channel inhibitors KCNN2, KCNH2, KCNJ2 FFAR1 3392/4885POLB 3642/4885ACHE 2642/4885
US-20030027829-A1 Amide substituted heteroaromatic bicylcyclic or tetrahydronaphthalene sulfonamide compounds are useful for treating arrhythmia KCNH1, KCNH2, KCNN2 FFAR1 1789/4885POLB 3758/4885ACHE 4104/4885
US-11634396-B2 Opioid receptor modulators OPRM1, OPRK1, OPRL1 FFAR1 235/4885POLB 4515/4885ACHE 418/4885
US-20140336198-A1 Amine Derivatives as Potassium Channel Blockers KCNA3, KCNH3, KCNK3 FFAR1 2942/4885POLB 3795/4885ACHE 712/4885
US-20150299184-A1 Amine Derivatives as Potassium Channel Blockers KCNA3, KCNH3, KCNK3 FFAR1 2942/4885POLB 3795/4885ACHE 712/4885

“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.