SCHEMBL3247325

SCHEMBL3247325

CC(N=CC(F)(F)F)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.44
MAPT P10636 2/20 0.44
HPGD P15428 2/20 0.44
KDM4E B2RXH2 2/20 0.44
USP2 O75604 1/20 0.44
POLB P06746 1/20 0.44
GAA P10253 1/20 0.44
ALOX15 P16050 1/20 0.44
ALOX12 P18054 1/20 0.44
RECQL P46063 1/20 0.44
HSD17B10 Q99714 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
MIF P14174 2/20 0.42
NOS2 P35228 1/20 0.40
NPSR1 Q6W5P4 1/20 0.39
HTT P42858 1/20 0.36
TAAR1 Q96RJ0 2/20 0.33
LMNA P02545 2/20 0.33
PDE2A O00408 1/20 0.33
RIPK1 Q13546 1/20 0.33

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
SCHEMBL3253401 1.00 ALDH1A1 (0.44) ALDH1A1MAPTHPGDKDM4EUSP2
SCHEMBL3253451 1.00 ALDH1A1 (0.44) ALDH1A1MAPTHPGDKDM4EUSP2
SCHEMBL3249042 1.00 ALDH1A1 (0.44) ALDH1A1MAPTHPGDKDM4EUSP2
SCHEMBL7756589 0.86 ALDH1A1 (0.45) ALDH1A1MAPTHPGDKDM4EUSP2
SCHEMBL7758429 0.86 ALDH1A1 (0.45) ALDH1A1MAPTHPGDKDM4EUSP2
SCHEMBL7756594 0.86 ALDH1A1 (0.45) ALDH1A1MAPTHPGDKDM4EUSP2
SCHEMBL7758434 0.86 ALDH1A1 (0.45) ALDH1A1MAPTHPGDKDM4EUSP2
SCHEMBL7756599 0.86 ALDH1A1 (0.45) ALDH1A1MAPTHPGDKDM4EUSP2
SCHEMBL29159446 0.86 ALDH1A1 (0.45) ALDH1A1MAPTHPGDKDM4EUSP2
SCHEMBL23372977 0.76 ALDH1A1 (0.50) ALDH1A1MAPTHPGDKDM4EUSP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2181996-A1 Aminopiperidine derivatives GLAXO GROUP LIMITED (GB) 2010-05-05 EP disclosed
US-7312212-B2 Aminopiperidine derivatives GLAXO GROUP LIMITED (GB) 2007-12-25 US disclosed
EP-1799637-A1 SUBSTITUTED SULFONAMIDOPROPIONAMIDES AND METHODS OF USE Amgen, Inc (US) 2007-06-27 EP disclosed
WO-2006036664-A1 SUBSTITUTED SULFONAMIDOPROPIONAMIDES AND METHODS OF USE AMGEN INC. (US) 2006-04-06 WO disclosed
US-20050159411-A1 Aminopiperidine derivatives GLAXO GROUP LIMITED (GB) 2005-07-21 US disclosed
EP-1470125-A1 AMINOPIPERIDINE DERIVATIVES GLAXO GROUP LIMITED (GB) 2004-10-27 EP disclosed
WO-2003064421-A1 AMINOPIPERIDINE DERIVATIVES GLAXO GROUP LIMITED (GB) 2003-08-07 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-20050159411-A1 Aminopiperidine derivatives AMPD2, AMPD3, NPEPPS ALDH1A1 1245/4885MAPT 4285/4885HPGD 350/4885

“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.