SCHEMBL4282001

SCHEMBL4282001

CCOC(=O)c1cc(C)n(CC[C@@H]2CNCCN2C(=O)c2ncn([C@@H]3CCCC[C@@]3(O)COC)c2-c2ccccc2)n1

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
USP19 O94966 5/20 0.34
FAAH O00519 4/20 0.33
MGLL Q99685 1/20 0.31
AKT1 P31749 1/20 0.30
AKT2 P31751 1/20 0.30
GABRG2 P18507 1/20 0.30
GABRB3 P28472 1/20 0.30
GABRA5 P31644 1/20 0.30

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
SCHEMBL4294723 0.91 USP19 (0.36) USP19
SCHEMBL4287537 0.91 USP19 (0.35) USP19FAAH
SCHEMBL4289638 0.90 USP19 (0.34) USP19AKT1AKT2
SCHEMBL4285712 0.89 USP19 (0.35) USP19FAAH
SCHEMBL4287510 0.89 USP19 (0.34) USP19
SCHEMBL4285541 0.89 USP19 (0.34) USP19
SCHEMBL4287395 0.88 USP19 (0.34) USP19GABRG2GABRB3GABRA5
SCHEMBL4287616 0.87 USP19 (0.34) USP19
SCHEMBL4290018 0.86 USP19 (0.35) USP19AKT1AKT2
SCHEMBL4283742 0.85 USP19 (0.33) USP19AKT1AKT2

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 USP19 1993/4885FAAH 2632/4885MGLL 2197/4885
US-20090227560-A1 Substituted imidazole compound and use thereof REN, ACE, AGT USP19 1993/4885FAAH 2632/4885MGLL 2197/4885

“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.