SCHEMBL4288516

SCHEMBL4288516

O=C(O)N1CCN[C@H](CCOc2ccc(-n3ccnn3)cc2)C1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.47
GPR119 Q8TDV5 3/20 0.42
KCNH2 Q12809 2/20 0.42
PPARD Q03181 1/20 0.36
PPARA Q07869 1/20 0.36
PARP1 P09874 1/20 0.35
KDM1A O60341 3/20 0.34
REN P00797 4/20 0.34
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
CA4 P22748 2/20 0.33
CA9 Q16790 2/20 0.33
TEAD1 P28347 1/20 0.33
TEAD3 Q99594 1/20 0.33
JAK3 P52333 1/20 0.33
NOTUM Q6P988 3/20 0.33

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 SCHEMBL4291116 0.99 CYP19A1 (0.46) CYP19A1GPR119KCNH2PPARDPPARA
SCHEMBL4293515 0.86 MEN1 (0.43) GPR119KCNH2PARP1RENCA1
Hydrochloric Acid SCHEMBL4287634 0.85 MEN1 (0.42) GPR119KCNH2PARP1REN
Hydrochloric Acid SCHEMBL4283218 0.81 CYP2D6 (0.48) CYP19A1CA1CA2CA9
SCHEMBL4285472 0.81 CYP19A1 (0.48) CYP19A1GPR119KCNH2PPARDPPARA
SCHEMBL3493396 0.80 TEAD1 (0.46) PARP1RENCA1CA2CA4
SCHEMBL4282373 0.80 L3MBTL1 (0.47) PPARAPARP1CA1CA2CA4
SCHEMBL4751897 0.80 L3MBTL1 (0.47) PPARAPARP1CA1CA2CA4
Hydrochloric Acid SCHEMBL4293711 0.79 PARP1 (0.45) PARP1RENCA1CA2CA4
Hydrochloric Acid SCHEMBL4293709 0.79 PARP1 (0.45) PARP1RENCA1CA2CA4

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 CYP19A1 705/4885GPR119 310/4885KCNH2 664/4885

“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.