SCHEMBL4292301

SCHEMBL4292301

COC[C@]1(O)CCCC[C@H]1n1cnc(C(=O)N2CCNC[C@H]2Cc2cc(F)cc(F)c2)c1-c1cccc(F)c1

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
USP19 O94966 7/20 0.36
HCRTR1 O43613 9/20 0.33
HCRTR2 O43614 9/20 0.33
CYP3A4 P08684 1/20 0.32
DPP4 P27487 1/20 0.32
DPP7 Q9UHL4 1/20 0.32
REN P00797 1/20 0.31
CDK9 P50750 1/20 0.31
PSEN1 P49768 1/20 0.31
PSEN2 P49810 1/20 0.31
APH1B Q8WW43 1/20 0.31
NCSTN Q92542 1/20 0.31
APH1A Q96BI3 1/20 0.31
PSENEN Q9NZ42 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
SCHEMBL4289705 0.97 USP19 (0.36) USP19HCRTR1HCRTR2CYP3A4DPP4
SCHEMBL4292735 0.95 USP19 (0.36) USP19HCRTR1HCRTR2CYP3A4DPP4
SCHEMBL4293872 0.95 USP19 (0.39) USP19HCRTR1HCRTR2CYP3A4DPP4
SCHEMBL4281650 0.95 USP19 (0.39) USP19HCRTR1HCRTR2CYP3A4DPP4
SCHEMBL13705378 0.95 USP19 (0.38) USP19HCRTR1HCRTR2CYP3A4DPP4
Hydrochloric Acid SCHEMBL4285546 0.94 USP19 (0.38) USP19HCRTR1HCRTR2DPP4DPP7
SCHEMBL4289693 0.92 DPP4 (0.38) USP19HCRTR1HCRTR2CYP3A4DPP4
SCHEMBL4293870 0.92 USP19 (0.35) USP19HCRTR1HCRTR2CYP3A4DPP4
SCHEMBL4283650 0.91 USP19 (0.36) USP19HCRTR1HCRTR2DPP4DPP7
SCHEMBL13705374 0.88 CA1 (0.40) USP19HCRTR1HCRTR2CYP3A4DPP4

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 USP19 1993/4885HCRTR1 3147/4885HCRTR2 3136/4885
US-20090227560-A1 Substituted imidazole compound and use thereof REN, ACE, AGT USP19 1993/4885HCRTR1 3147/4885HCRTR2 3136/4885

“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.