SCHEMBL4301418

SCHEMBL4301418

CC1(C)Cc2cc(OCC[C@@H]3CN(C(=O)O)CCN3)cc(F)c2O1

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 5/20 0.37
GAA P10253 2/20 0.35
MEN1 O00255 1/20 0.33
LMNA P02545 1/20 0.33
KMT2A Q03164 1/20 0.33
GYS1 P13807 1/20 0.33
HTR1A P08908 1/20 0.32
DRD2 P14416 1/20 0.32
ADRA1A P35348 1/20 0.32
CA1 P00915 2/20 0.32
CA2 P00918 2/20 0.32
CA4 P22748 2/20 0.32
CA9 Q16790 2/20 0.32
GPR119 Q8TDV5 2/20 0.31

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
SCHEMBL4290342 0.86 KDM4E (0.39) GAAMEN1KMT2A
SCHEMBL4283529 0.83 FFAR4 (0.40) FFAR4GAAMEN1LMNAKMT2A
SCHEMBL4288465 0.80 LMNA (0.49) GAAMEN1LMNAKMT2A
SCHEMBL4750064 0.79 CA1 (0.36) CA1CA2CA4CA9
SCHEMBL4291240 0.79 CA1 (0.36) CA1CA2CA4CA9
SCHEMBL4289137 0.74 CPS1 (0.39) GPR119
SCHEMBL4284889 0.74 SCN9A (0.40) GAALMNAKMT2A
Hydrochloric Acid SCHEMBL4285448 0.73 CPS1 (0.40)
SCHEMBL3493396 0.73 TEAD1 (0.46) GAAMEN1KMT2ACA1CA2
SCHEMBL4291606 0.73 SCN9A (0.38)

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 2 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

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 FFAR4 3121/4885GAA 1381/4885MEN1 1254/4885
US-20090227560-A1 Substituted imidazole compound and use thereof REN, ACE, AGT FFAR4 3121/4885GAA 1381/4885MEN1 1254/4885

“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.