SCHEMBL4292957

SCHEMBL4292957

NCC1(O)CCC(N2CCOCC2=O)CC1

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
F10 P00742 3/20 0.35
DPP4 P27487 1/20 0.33
DPP8 Q6V1X1 1/20 0.33
DPP9 Q86TI2 1/20 0.33
TACR1 P25103 1/20 0.33
CYP2C19 P33261 1/20 0.32
POLB P06746 1/20 0.31
GAA P10253 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
PIK3CD O00329 2/20 0.31
ALDH1A1 P00352 1/20 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
SCHEMBL3828646 0.79 CYP2C19 (0.42) F10TACR1CYP2C19PIK3CDALDH1A1
SCHEMBL4283864 0.79 F10 (0.33) F10TACR1CYP2C19PIK3CDALDH1A1
SCHEMBL29865291 0.78 F10 (0.38) F10TACR1POLBGAASMN1; SMN2
SCHEMBL15972321 0.74 DGAT1 (0.38) F10CYP2C19POLBGAASMN1; SMN2
SCHEMBL76628 0.73 F10 (0.35) F10POLBGAASMN1; SMN2PIK3CD
SCHEMBL85150 0.73 F10 (0.35) F10POLBGAASMN1; SMN2PIK3CD
SCHEMBL7886958 0.73 MEN1 (0.39) F10CYP2C19POLBGAASMN1; SMN2
SCHEMBL13298972 0.73 F10 (0.38) F10POLBGAASMN1; SMN2PIK3CD
SCHEMBL14191226 0.72 F10 (0.37) F10CYP2C19POLBGAASMN1; SMN2
SCHEMBL4475218 0.72 F10 (0.35) F10POLBGAASMN1; SMN2PIK3CD

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 8 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-20090227560-A1 Substituted imidazole compound and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-09-10 US disclosed
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
US-20090156612-A1 Substituted imidazole compound and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-06-18 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
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 F10 3008/4885DPP4 113/4885DPP8 193/4885
US-20090227560-A1 Substituted imidazole compound and use thereof REN, ACE, AGT F10 3008/4885DPP4 113/4885DPP8 193/4885

“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.