SCHEMBL1808417

SCHEMBL1808417

CC(C(=O)S)c1cncnc1

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 1/20 0.38
VNN1 O95497 4/20 0.33
CYP19A1 P11511 1/20 0.32
DYRK1A Q13627 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
SCHEMBL27922982 0.82 HCAR2 (0.41) HCAR2VNN1CYP19A1
SCHEMBL27405232 0.80 PTGS2 (0.45) HCAR2
SCHEMBL1484347 0.78 EPHX1 (0.44) HCAR2VNN1CYP19A1
SCHEMBL11838106 0.74 CYP19A1 (0.47) CYP19A1
SCHEMBL1808418 0.71 HCAR2 (0.34) HCAR2CYP19A1
SCHEMBL8922394 0.71 AKR1C3 (0.35) HCAR2
SCHEMBL27485847 0.71 APP (0.42) HCAR2VNN1CYP19A1
SCHEMBL24683919 0.69
SCHEMBL18427397 0.69
SCHEMBL6980862 0.69

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-7935700-B2 Morpholine compound MITSUBISHI TANABE PHARMA CORPORATION (JP) 2011-05-03 US disclosed
US-20070265257-A1 Morpholine Compound MITSUBISHI PHARMA CORPORATION (JP) 2007-11-15 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-20070265257-A1 Morpholine Compound CCR3, CCR1, CCR4 HCAR2 967/4885VNN1 4538/4885CYP19A1 2951/4885

“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.