SCHEMBL4290635

SCHEMBL4290635

Cn1nc(C(F)(F)F)cc1OCC[C@@H]1CN(C(=O)O)CCN1C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.46
KMT2A Q03164 2/20 0.36
GPR119 Q8TDV5 1/20 0.35
PKM P14618 1/20 0.32
ADORA2A P29274 1/20 0.31
ADORA1 P30542 1/20 0.31
GAA P10253 1/20 0.31
VNN1 O95497 1/20 0.31
MEN1 O00255 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
TGFBR1 P36897 1/20 0.31
PIK3CD O00329 1/20 0.30
CTSK P43235 1/20 0.30
SPTLC2 O15270 1/20 0.30
AGTR2 P50052 1/20 0.30

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
SCHEMBL4282230 0.82 PKM (0.52) KMT2APKMGAAMEN1MAPT
Hydrochloric Acid SCHEMBL4283589 0.80 ALDH1A1 (0.42) ALDH1A1KMT2AGPR119
SCHEMBL4281389 0.76 RBP4 (0.38) ALDH1A1KMT2AGAAMAPT
SCHEMBL4283350 0.75 SCN9A (0.39) ALDH1A1KMT2AGAA
SCHEMBL4295523 0.74 HCRTR1 (0.36) MAPT
SCHEMBL4281879 0.73 KDM4E (0.36) ALDH1A1KMT2AMEN1MAPT
SCHEMBL4282907 0.71 HCRTR1 (0.32)
SCHEMBL4290686 0.71 ENPP2 (0.43) ALDH1A1
SCHEMBL3494366 0.70 TEAD1 (0.50) ALDH1A1KMT2AGAAMEN1MAPT
SCHEMBL4281983 0.70 L3MBTL1 (0.48) ALDH1A1KMT2APKMGAAMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 (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-20090156612-A1 Substituted imidazole compound and use thereof REN, ACE, AGT ALDH1A1 388/4885KMT2A 1049/4885GPR119 310/4885

“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.