SCHEMBL4298262

SCHEMBL4298262

COc1cccc(O[C@@H](C)OC(=O)N2CCN(C(=O)O[C@H](C)Oc3cccc(OC)c3OC)CC2)c1OC

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.45
HTT P42858 2/20 0.45
POLB P06746 1/20 0.45
CYP1A2 P05177 1/20 0.44
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
LMNA P02545 2/20 0.43
GAA P10253 1/20 0.43
ABHD6 Q9BV23 2/20 0.41
GABRA1 P14867 2/20 0.40
GABRG2 P18507 2/20 0.40
GABRB3 P28472 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
CYP2C19 P33261 1/20 0.40

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
SCHEMBL4752576 0.86 KMT2A (0.43) ALDH1A1HTTPOLBMEN1KMT2A
SCHEMBL4303757 0.85 ABHD6 (0.41) ALDH1A1HTTPOLBMEN1KMT2A
SCHEMBL4752523 0.85 ABHD6 (0.43) ALDH1A1HTTPOLBMEN1KMT2A
SCHEMBL4301342 0.78 ALDH1A1 (0.42) ALDH1A1POLBMEN1KMT2AABHD6
SCHEMBL4293508 0.78 ALDH1A1 (0.42) ALDH1A1POLBMEN1KMT2AABHD6
SCHEMBL4297012 0.78 MEN1 (0.46) ALDH1A1HTTMEN1KMT2ALMNA
SCHEMBL4753584 0.78 ALDH1A1 (0.46) ALDH1A1HTTKMT2ALMNAGAA
SCHEMBL4752095 0.77 ALDH1A1 (0.48) ALDH1A1POLBLMNAGAA
SCHEMBL4296960 0.77 L3MBTL1 (0.47) ALDH1A1POLBMEN1KMT2ALMNA
SCHEMBL4753498 0.76 ALDH1A1 (0.48) ALDH1A1POLBMEN1KMT2AGAA

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 ALDH1A1 388/4885HTT 4390/4885POLB 3799/4885

“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.