SCHEMBL4295458

SCHEMBL4295458

CCN(CC)c1cccc(OCC[C@@H]2CN(C(=O)O)CCN2)c1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.39
KDM4E B2RXH2 3/20 0.39
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
THRB P10828 1/20 0.39
MAPT P10636 2/20 0.37
REN P00797 2/20 0.36
SCN9A Q15858 5/20 0.35
CCR3 P51677 1/20 0.35
CYP2D6 P10635 2/20 0.35
PARP1 P09874 1/20 0.35
SCN10A Q9Y5Y9 1/20 0.35
LMNA P02545 1/20 0.35
MAPK1 P28482 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
GHSR Q92847 1/20 0.35
GAA P10253 1/20 0.34
CACNA1B Q00975 1/20 0.34

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
Hydrochloric Acid SCHEMBL4290859 0.99 ALDH1A1 (0.38) ALDH1A1KDM4EKMT2AMEN1THRB
SCHEMBL4285458 0.83 KDM4E (0.41) ALDH1A1KDM4EKMT2AMEN1REN
SCHEMBL3493396 0.83 TEAD1 (0.46) ALDH1A1KDM4EKMT2AMEN1MAPT
SCHEMBL4289872 0.82 KDM4E (0.38) ALDH1A1KDM4EKMT2AMEN1MAPT
SCHEMBL4284610 0.82 REN (0.44) ALDH1A1KDM4EKMT2AMEN1REN
Hydrochloric Acid SCHEMBL4283409 0.82 MAOB (0.44) ALDH1A1KMT2AMEN1
Hydrochloric Acid SCHEMBL4293711 0.81 PARP1 (0.45) ALDH1A1KDM4EKMT2AMEN1MAPT
Hydrochloric Acid SCHEMBL4293709 0.81 PARP1 (0.45) ALDH1A1KDM4EKMT2AMEN1MAPT
SCHEMBL4284770 0.81 ALDH1A1 (0.41) ALDH1A1KDM4EKMT2AMAPTCCR3
SCHEMBL4294089 0.81 KDM4E (0.39) ALDH1A1KDM4EKMT2AMEN1THRB

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 388/4885KDM4E 760/4885KMT2A 1049/4885

“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.