SCHEMBL4921050

SCHEMBL4921050

Fc1ccc(Cc2ccccc2CCl)cc1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.40
HSP90AA1 P07900 1/20 0.40
HSP90B1 P14625 1/20 0.40
PKM P14618 1/20 0.40
HTR2A P28223 1/20 0.39
KEAP1 Q14145 1/20 0.39
SLC5A1 P13866 1/20 0.38
SLC5A2 P31639 1/20 0.38
KDM4E B2RXH2 1/20 0.38
IDO1 P14902 1/20 0.38
LOXL2 Q9Y4K0 1/20 0.38
MPO P05164 1/20 0.38
SLC6A2 P23975 2/20 0.37
SLC6A4 P31645 2/20 0.37
SLC6A3 Q01959 2/20 0.37

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
SCHEMBL5188628 0.89 HTR2A (0.46) ALDH1A1HSP90AA1HSP90B1PKMHTR2A
SCHEMBL11146428 0.85 HTR2A (0.43) ALDH1A1HTR2AKEAP1SLC6A2SLC6A4
SCHEMBL3821433 0.82 HTR2A (0.56) HTR2AKEAP1
SCHEMBL4869623 0.79 MPO (0.45) ALDH1A1HSP90AA1HSP90B1PKMHTR2A
SCHEMBL2089904 0.79 KDM4E (0.53) ALDH1A1KDM4EIDO1SLC6A2SLC6A4
SCHEMBL5156201 0.79 SLC5A1 (0.41) ALDH1A1HSP90AA1HSP90B1PKMHTR2A
SCHEMBL27473436 0.79 LMNA (0.44) ALDH1A1HSP90AA1HSP90B1PKMHTR2A
SCHEMBL8875929 0.79 ALDH1A1 (0.41) ALDH1A1SLC5A1SLC5A2KDM4EIDO1
SCHEMBL2564249 0.78 TAAR1 (0.46) ALDH1A1PKMHTR2AKEAP1IDO1
Hydrochloric Acid SCHEMBL27607292 0.78 ALDH1A1 (0.51) ALDH1A1PKMKDM4EIDO1SLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1789375-B1 PROCESS FOR THE PRODUCTION OF [2-(4-FLUORO-BENZYL)-PHENYL]-ACETIC ACID JANSSEN PHARMACEUTICA NV (BE) 2015-12-09 EP disclosed
EP-1789375-B1 PROCESS FOR THE PRODUCTION OF [2-(4-FLUORO-BENZYL)-PHENYL]-ACETIC ACID JANSSEN PHARMACEUTICA NV (BE) 2015-12-09 EP disclosed
CN-100591652-C Method for producing 2-(4-fluoro-benzyl)-phenyl-acetic acid JANSSEN PHARMACEUTICA NV 2010-02-24 CN disclosed
US-7470809-B2 Process for the production of [2-(4-fluoro-benzyl)-phenyl]-acetic acid JANSSEN PHARMACEUTICA N.V. (BE) 2008-12-30 US disclosed
US-7470809-B2 Process for the production of [2-(4-fluoro-benzyl)-phenyl]-acetic acid JANSSEN PHARMACEUTICA N.V. (BE) 2008-12-30 US disclosed
US-7470809-B2 Process for the production of [2-(4-fluoro-benzyl)-phenyl]-acetic acid JANSSEN PHARMACEUTICA N.V. (BE) 2008-12-30 US disclosed
US-20070213556-A1 NOVEL PROCESS FOR THE PRODUCTION OF [2-(4-FLUORO-BENZYL)-PHENYL]-ACETIC ACID JANSSEN PHARMACEUTICA N.V. (BE) 2007-09-13 US disclosed
US-20070213556-A1 NOVEL PROCESS FOR THE PRODUCTION OF [2-(4-FLUORO-BENZYL)-PHENYL]-ACETIC ACID JANSSEN PHARMACEUTICA N.V. (BE) 2007-09-13 US disclosed
US-20070213556-A1 NOVEL PROCESS FOR THE PRODUCTION OF [2-(4-FLUORO-BENZYL)-PHENYL]-ACETIC ACID JANSSEN PHARMACEUTICA N.V. (BE) 2007-09-13 US disclosed
CN-101006039-A Method for producing 2-(4-fluoro-benzyl)-phenyl-acetic acid JANSSEN PHARMACEUTICA NV (BE) 2007-07-25 CN disclosed
EP-1789375-A1 PROCESS FOR THE PRODUCTION OF ¬2-(4-FLUORO-BENZYL)-PHENYL|-ACETIC ACID JANSSEN PHARMACEUTICA N.V. (BE) 2007-05-30 EP disclosed
WO-2006024630-A1 PROCESS FOR THE PRODUCTION OF [2- (4-FLUORO-BENZYL) -PHENYL] -ACETIC ACID JANSSEN PHARMACEUTICA N.V. (BE) 2006-03-09 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-20070213556-A1 NOVEL PROCESS FOR THE PRODUCTION OF [2-(4-FLUORO-BENZYL)-PHENYL]-ACETIC ACID ADH1A, ADH1C, CA4 ALDH1A1 15/4885HSP90AA1 2696/4885HSP90B1 4098/4885

“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.