SCHEMBL4283648

SCHEMBL4283648

Cn1c(=O)n(CC[C@@H]2CN(C(=O)O)CCN2C(=O)O)c2ccccc21

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.43
POLB P06746 1/20 0.42
THRB P10828 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
HTT P42858 2/20 0.41
TP53 P04637 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CYP1A2 P05177 1/20 0.39
CXCR3 P49682 2/20 0.38
AGER Q15109 1/20 0.38
TSHR P16473 2/20 0.38
ALDH1A1 P00352 4/20 0.38
MEN1 O00255 2/20 0.38
NPC1 O15118 2/20 0.38
KMT2A Q03164 2/20 0.38
GAA P10253 1/20 0.38
RAB9A P51151 1/20 0.38

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
SCHEMBL4295055 0.80 LMNA (0.35) LMNA
SCHEMBL4293871 0.80 HPGD (0.51) LMNAPOLBHTTSMN1; SMN2CYP1A2
SCHEMBL4291290 0.80 ALDH1A1 (0.51) LMNAPOLBL3MBTL1HTTSMN1; SMN2
Hydrochloric Acid SCHEMBL4301989 0.77 LMNA (0.41) LMNAPOLBTHRBL3MBTL1HTT
Hydrochloric Acid SCHEMBL4282258 0.77 LMNA (0.41) LMNAPOLBTHRBL3MBTL1HTT
SCHEMBL4290177 0.75 LMNA (0.45) LMNATP53SMN1; SMN2TSHRKMT2A
SCHEMBL4286339 0.75 SMN1; SMN2 (0.37) LMNASMN1; SMN2ALDH1A1
SCHEMBL4288884 0.74 ADRA2A (0.52) LMNAL3MBTL1HTTSMN1; SMN2TSHR
SCHEMBL4285897 0.74 KMO (0.51) POLBL3MBTL1SMN1; SMN2CYP1A2TSHR
SCHEMBL4281778 0.74 RAB9A (0.52) POLBSMN1; SMN2TSHRALDH1A1MEN1

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 LMNA 1785/4885POLB 3799/4885THRB 2751/4885
US-20090227560-A1 Substituted imidazole compound and use thereof REN, ACE, AGT LMNA 1785/4885POLB 3799/4885THRB 2751/4885

“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.