SCHEMBL5849010

SCHEMBL5849010

O=C(CCCOn1nnc2ccccc21)N1CCN(c2ncnc3sc(CC(F)(F)F)cc23)CC1

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
P2RY12 Q9H244 6/20 0.50
MEN1 O00255 14/20 0.47
KMT2A Q03164 8/20 0.46
KDM1A O60341 4/20 0.43
MAOA P21397 4/20 0.43
MAOB P27338 4/20 0.43

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
SCHEMBL5848928 0.90 P2RY12 (0.59) P2RY12MEN1KMT2A
SCHEMBL5849213 0.89 P2RY12 (0.51) P2RY12MEN1KMT2A
SCHEMBL5849494 0.89 P2RY12 (0.49) P2RY12MEN1KMT2A
SCHEMBL5850838 0.89 P2RY12 (0.53) P2RY12MEN1KMT2A
SCHEMBL5850723 0.87 P2RY12 (0.50) P2RY12MEN1KMT2A
SCHEMBL5851220 0.87 P2RY12 (0.44) P2RY12MEN1KMT2A
SCHEMBL5849059 0.87 P2RY12 (0.44) P2RY12MEN1KMT2A
SCHEMBL5849680 0.87 P2RY12 (0.46) P2RY12MEN1KMT2A
SCHEMBL5850752 0.86 P2RY12 (0.44) P2RY12MEN1KMT2A
SCHEMBL5851312 0.85 KDM4E (0.56) P2RY12MEN1KMT2A

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-7115741-B2 4-thieno[2,3-D]pyrimidin-4-YL piperazine compounds ALEXION PHARMACEUTICALS, INC. 2006-10-03 US disclosed
US-20030153556-A1 Piperazine and homopiperazine compounds MILLENNIUM PHARMACEUTICALS, INC. 2003-08-14 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-20030153556-A1 Piperazine and homopiperazine compounds HAMP, MPL, F2 P2RY12 111/4885MEN1 2603/4885KMT2A 1823/4885

“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.