SCHEMBL5394170

SCHEMBL5394170

CCOC(=O)C1CN(C(=O)OC(C)(C)C)CCN1c1ccc(C(F)(F)F)cc1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 5/20 0.48
ALDH1A1 P00352 3/20 0.47
KDM4E B2RXH2 1/20 0.47
MAPT P10636 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.43
HPGD P15428 1/20 0.43
NR1H2 P55055 1/20 0.40
NR1H3 Q13133 1/20 0.40
ENPP2 Q13822 1/20 0.40
MMP13 P45452 1/20 0.40
LIPE Q05469 1/20 0.39
TACR1 P25103 1/20 0.39
RAB9A P51151 1/20 0.39
RORC P51449 1/20 0.39

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
SCHEMBL5395589 0.89 GPR119 (0.42) GPR119ALDH1A1MAPTMMP13RAB9A
SCHEMBL13923464 0.88 MAPT (0.52) GPR119ALDH1A1MAPTNR1H2NR1H3
SCHEMBL5394205 0.85 GPR119 (0.52) GPR119ALDH1A1MAPTNR1H2NR1H3
SCHEMBL3921237 0.82 GPR119 (0.53) GPR119MAPTRORC
SCHEMBL13940334 0.81 GPR119 (0.50) GPR119ALDH1A1MAPTSMN1; SMN2NR1H2
SCHEMBL21800250 0.80 ADAMTS5 (0.38) GPR119ALDH1A1KDM4ESMN1; SMN2HPGD
SCHEMBL5395741 0.78 HDAC6 (0.44) GPR119ALDH1A1KDM4EMAPTHPGD
SCHEMBL5398512 0.78 SMN1; SMN2 (0.46) GPR119ALDH1A1MAPTSMN1; SMN2HPGD
SCHEMBL5408519 0.77 ALDH1A1 (0.53) ALDH1A1KDM4ESMN1; SMN2
SCHEMBL5390992 0.77 MAPT (0.44) GPR119ALDH1A1MAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7214680-B2 2-substituted 1-arylpiperazines as tachykinin antagonists and/or serotonin reuptake inhibitors GLAXO GROUP LIMITED (GB) 2007-05-08 US disclosed
US-20040242592-A1 2-Substituted 1-arylpiperazines as tachykinin antagonists and/or serotonin reuptake inhibitors GLAXO GROUP LIMITED (GB) 2004-12-02 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 (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-20040242592-A1 2-Substituted 1-arylpiperazines as tachykinin antagonists and/or serotonin reuptake inhibitors SLC6A4, TPH1, HTR1D GPR119 563/4885ALDH1A1 1543/4885KDM4E 2349/4885

“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.