SCHEMBL4290915

SCHEMBL4290915

Cc1ccc(Cl)cc1NCC[C@@H]1CN(C(=O)O)CCN1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.41
MAPT P10636 2/20 0.39
POLB P06746 1/20 0.39
GAA P10253 1/20 0.39
F2 P00734 1/20 0.38
MEN1 O00255 2/20 0.38
PAK4 O96013 1/20 0.37
PAK1 Q13153 1/20 0.37
HTT P42858 1/20 0.37
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
THRB P10828 1/20 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
SCHEMBL8124038 0.85 XIAP (0.43) MAPTPOLBHTT
SCHEMBL4750102 0.84 MAPT (0.41) KMT2AMAPTGAAMEN1HTT
SCHEMBL4289461 0.80 EBP (0.40) KMT2AMAPTGAA
SCHEMBL4281547 0.80 KMT2A (0.41) KMT2AMAPTPOLBGAAMEN1
SCHEMBL4750112 0.79 RAB9A (0.40) KMT2AGAAMEN1HTTALDH1A1
SCHEMBL4281831 0.79 RAB9A (0.40) KMT2AGAAMEN1HTTALDH1A1
SCHEMBL4287630 0.78 ALDH1A1 (0.44) KMT2AMAPTGAAMEN1ALDH1A1
SCHEMBL4294740 0.76 MAN1B1 (0.43) POLBGAA
SCHEMBL4291328 0.76 CA1 (0.38) KMT2AMEN1ALDH1A1LMNA
SCHEMBL4284858 0.73 CA1 (0.42) MAPTPOLBHTTALDH1A1LMNA

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 KMT2A 1049/4885MAPT 3142/4885POLB 3799/4885
US-20090227560-A1 Substituted imidazole compound and use thereof REN, ACE, AGT KMT2A 1049/4885MAPT 3142/4885POLB 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.