SCHEMBL4297922

SCHEMBL4297922

CC(=O)c1ccc(O[C@@H](C)OC(=O)N2CCN(C(=O)O[C@H](C)Oc3ccc(C(C)=O)cc3F)CC2)c(F)c1

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.50
SLC6A9 P48067 2/20 0.45
ALDH1A1 P00352 7/20 0.42
HPGD P15428 2/20 0.42
MAPT P10636 5/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
POLB P06746 1/20 0.42
GAA P10253 1/20 0.42
KMT2A Q03164 4/20 0.41
MEN1 O00255 2/20 0.41
PKM P14618 1/20 0.41
LMNA P02545 2/20 0.40
HRH3 Q9Y5N1 2/20 0.39
NPC1 O15118 1/20 0.39
HTT P42858 1/20 0.39
RAB9A P51151 1/20 0.39
PARP1 P09874 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
SCHEMBL4292826 0.85 ALDH1A1 (0.50) L3MBTL1ALDH1A1HPGDMAPTSMN1; SMN2
SCHEMBL4294973 0.84 MGLL (0.40) L3MBTL1ALDH1A1MAPTSMN1; SMN2POLB
SCHEMBL4752309 0.83 PPARG (0.48) L3MBTL1ALDH1A1MAPTSMN1; SMN2KMT2A
SCHEMBL4295179 0.83 KDM4E (0.44) L3MBTL1ALDH1A1HPGDMAPTSMN1; SMN2
SCHEMBL4288154 0.82 CPS1 (0.52) L3MBTL1ALDH1A1
SCHEMBL4752095 0.80 ALDH1A1 (0.48) ALDH1A1HPGDSMN1; SMN2POLBGAA
SCHEMBL1091884 0.77 KCNQ3 (0.53) SLC6A9ALDH1A1HPGDMAPTPOLB
SCHEMBL4293508 0.75 ALDH1A1 (0.42) ALDH1A1MAPTSMN1; SMN2POLBKMT2A
SCHEMBL4301342 0.75 ALDH1A1 (0.42) ALDH1A1MAPTSMN1; SMN2POLBKMT2A
SCHEMBL30108554 0.74 HTT (0.49) ALDH1A1MAPTSMN1; SMN2GAALMNA

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-20090227560-A1 Substituted imidazole compound and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-09-10 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-20090227560-A1 Substituted imidazole compound and use thereof REN, ACE, AGT L3MBTL1 3597/4885SLC6A9 357/4885ALDH1A1 388/4885

“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.