SCHEMBL5517548

SCHEMBL5517548

O=C(C1CCC2(CC1)OCCO2)N(Cc1ccccc1)Cc1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.60
KMT2A Q03164 3/20 0.60
C5AR1 P21730 1/20 0.50
GAA P10253 3/20 0.45
KDM4E B2RXH2 4/20 0.44
LMNA P02545 3/20 0.44
CHRM5 P08912 2/20 0.44
LPAR1 Q92633 2/20 0.44
LPAR5 Q9H1C0 2/20 0.44
TSHR P16473 1/20 0.43
ALDH1A1 P00352 3/20 0.42
MAPT P10636 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
OPRM1 P35372 1/20 0.41
POLB P06746 1/20 0.41

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
SCHEMBL29764514 0.82 MEN1 (0.86) MEN1KMT2AGAAKDM4ELMNA
SCHEMBL6061686 0.82 MEN1 (0.86) MEN1KMT2AGAAKDM4ELMNA
SCHEMBL5722067 0.79 MEN1 (0.61) MEN1KMT2AGAAKDM4ELMNA
SCHEMBL15020608 0.78 MEN1 (0.60) MEN1KMT2AGAAKDM4ELMNA
SCHEMBL6061687 0.77 MEN1 (0.78) MEN1KMT2AGAAKDM4ELMNA
SCHEMBL28694741 0.77 MEN1 (0.73) MEN1KMT2AGAAKDM4ELMNA
Oxalic Acid SCHEMBL7908190 0.76 C5AR1 (0.54) C5AR1LMNATSHROPRM1
SCHEMBL29918604 0.75 MEN1 (0.60) MEN1KMT2AGAAKDM4ELMNA
SCHEMBL9260456 0.75 MEN1 (0.69) MEN1KMT2AGAAKDM4ELMNA
SCHEMBL9260459 0.75 MEN1 (0.69) MEN1KMT2AGAAKDM4ELMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070167452-A1 Therapeutic amide derivatives PFIZER, INC. 2007-07-19 US disclosed
US-20070167452-A1 Therapeutic amide derivatives PFIZER, INC. 2007-07-19 US disclosed
US-20070167452-A1 Therapeutic amide derivatives PFIZER, INC. 2007-07-19 US disclosed
EP-1716100-A2 THERAPEUTIC AMIDE DERIVATIVES Pfizer, Inc. (US) 2006-11-02 EP disclosed
WO-2005080317-A2 THERAPEUTIC AMIDE DERIVATIVES PFIZER JAPAN, INC. (JP) 2005-09-01 WO disclosed
WO-2005080317-A2 THERAPEUTIC AMIDE DERIVATIVES PFIZER JAPAN, INC. (JP) 2005-09-01 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-20070167452-A1 Therapeutic amide derivatives GRIN1, GRIN2B, GRIN3A MEN1 3887/4885KMT2A 1221/4885C5AR1 1122/4885

“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.