SCHEMBL4285550

SCHEMBL4285550

COc1cccc(OCC[C@@H]2CN(C(=O)O)CCN2C(=O)O)c1C

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
LMNA P02545 2/20 0.39
KDM4E B2RXH2 4/20 0.36
TDP1 Q9NUW8 2/20 0.36
ALDH1A1 P00352 5/20 0.36
DRD2 P14416 1/20 0.36
DRD3 P35462 1/20 0.36
MAPT P10636 2/20 0.36
HTT P42858 2/20 0.36

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
SCHEMBL4287638 0.90 LMNA (0.50) MEN1KMT2ALMNAKDM4ETDP1
SCHEMBL4293729 0.89 MAPK1 (0.41) MEN1KMT2ALMNAKDM4EALDH1A1
SCHEMBL4281106 0.88 BTK (0.39) LMNAKDM4ETDP1ALDH1A1DRD2
SCHEMBL4297009 0.85 KDM4E (0.47) MEN1KMT2AKDM4ETDP1ALDH1A1
SCHEMBL4285501 0.84 RAB9A (0.41) MEN1KMT2AKDM4EALDH1A1
SCHEMBL4285755 0.83 KDM4E (0.51) MEN1KMT2ALMNAKDM4ETDP1
SCHEMBL4287941 0.83 KDM4E (0.47) MEN1KMT2AKDM4ETDP1ALDH1A1
SCHEMBL4284656 0.83 FFAR1 (0.42) MEN1KMT2AKDM4EALDH1A1
SCHEMBL4294041 0.83 HCRTR1 (0.40) MEN1KMT2AKDM4EALDH1A1
SCHEMBL4282070 0.81 NPC1 (0.48) MEN1KMT2ALMNAKDM4EALDH1A1

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 3 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
WO-2008139941-A1 SUBSTITUTED IMIDAZOLE COMPOUND AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-11-20 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 (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 MEN1 1254/4885KMT2A 1049/4885LMNA 1785/4885
US-20090227560-A1 Substituted imidazole compound and use thereof REN, ACE, AGT MEN1 1254/4885KMT2A 1049/4885LMNA 1785/4885

“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.