SCHEMBL4281619

SCHEMBL4281619

N#Cc1cn(CC[C@@H]2CN(C(=O)O)CCN2C(=O)O)c2ccccc12

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
STAT3 P40763 1/20 0.51
ALDH1A1 P00352 7/20 0.49
SMN1; SMN2 Q16637 4/20 0.48
KMT2A Q03164 3/20 0.47
MAPT P10636 6/20 0.45
HTT P42858 1/20 0.45
POLB P06746 1/20 0.45
MEN1 O00255 2/20 0.44
PKM P14618 1/20 0.44
TSHR P16473 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
P2RX7 Q99572 1/20 0.44
L3MBTL1 Q9Y468 2/20 0.43
PRMT5 O14744 1/20 0.41

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
SCHEMBL4552154 1.00 STAT3 (0.51) STAT3ALDH1A1SMN1; SMN2KMT2AMAPT
Hydrochloric Acid SCHEMBL4293639 0.80 STAT3 (0.49) STAT3ALDH1A1SMN1; SMN2KMT2AMAPT
SCHEMBL4290177 0.76 LMNA (0.45) SMN1; SMN2KMT2ATSHR
SCHEMBL4288884 0.74 ADRA2A (0.52) ALDH1A1SMN1; SMN2KMT2AMAPTHTT
SCHEMBL4286339 0.73 SMN1; SMN2 (0.37) ALDH1A1SMN1; SMN2
SCHEMBL4283648 0.70 LMNA (0.43) ALDH1A1SMN1; SMN2KMT2AHTTPOLB
SCHEMBL4281778 0.70 RAB9A (0.52) ALDH1A1SMN1; SMN2KMT2AMAPTPOLB
SCHEMBL4285897 0.70 KMO (0.51) ALDH1A1SMN1; SMN2KMT2APOLBMEN1
SCHEMBL14884740 0.69 STAT3 (1.00) STAT3ALDH1A1SMN1; SMN2KMT2AMAPT
SCHEMBL4292117 0.69 ESR1 (0.52)

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 STAT3 1081/4885ALDH1A1 388/4885SMN1; SMN2 4811/4885

“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.