SCHEMBL4281940

SCHEMBL4281940

O=C(O)N1CCN(C(=O)O)[C@H](CCOc2ccc(Cl)cc2)C1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KCNA5 P22460 1/20 0.46
KMT2A Q03164 5/20 0.46
MEN1 O00255 4/20 0.46
ALDH1A1 P00352 3/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
HRH3 Q9Y5N1 13/20 0.45
HPGD P15428 3/20 0.45
RAB9A P51151 1/20 0.45
HTT P42858 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
LMNA P02545 1/20 0.44

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
SCHEMBL3494366 0.88 TEAD1 (0.50) KCNA5KMT2AMEN1ALDH1A1HPGD
SCHEMBL4286026 0.88 HPGD (0.49) KCNA5KMT2AALDH1A1L3MBTL1HPGD
SCHEMBL4286428 0.88 HCRTR1 (0.47) KCNA5ALDH1A1RAB9AHTT
SCHEMBL4281983 0.88 L3MBTL1 (0.48) KCNA5KMT2AMEN1ALDH1A1L3MBTL1
SCHEMBL4295216 0.87 KMT2A (0.49) KMT2AMEN1ALDH1A1L3MBTL1HRH3
SCHEMBL4285825 0.86 KCNA5 (0.49) KCNA5MEN1ALDH1A1HRH3
SCHEMBL4287625 0.86 KDM4E (0.50) KMT2AALDH1A1HRH3HTTLMNA
SCHEMBL4294542 0.85 KDM4E (0.49) ALDH1A1L3MBTL1HRH3NPSR1
SCHEMBL4287459 0.84 KMT2A (0.49) KMT2AMEN1ALDH1A1HRH3RAB9A
SCHEMBL4286463 0.83 GPR119 (0.49) HRH3

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-20090227560-A1 Substituted imidazole compound and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-09-10 US disclosed
US-20090156612-A1 Substituted imidazole compound and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-06-18 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 (2 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-20090156612-A1 Substituted imidazole compound and use thereof REN, ACE, AGT KCNA5 867/4885KMT2A 1049/4885MEN1 1254/4885
US-20090227560-A1 Substituted imidazole compound and use thereof REN, ACE, AGT KCNA5 867/4885KMT2A 1049/4885MEN1 1254/4885

“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.