SCHEMBL15050812

SCHEMBL15050812

C[Si](C)(C)CCOCn1cnnc1-c1cn(-c2ccnc(Cl)c2)nc1-c1ccccc1Cl

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 13/20 0.34
SMN1; SMN2 Q16637 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
DGAT1 O75907 1/20 0.31
MAPK14 Q16539 1/20 0.31
MAPT P10636 2/20 0.31
ALDH1A1 P00352 1/20 0.31
KDM4E B2RXH2 1/20 0.31
ALPL P05186 1/20 0.31
GAA P10253 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
SCHEMBL15050831 0.83 ALDH1A1 (0.31) SMN1; SMN2L3MBTL1MAPTALDH1A1KDM4E
SCHEMBL15051241 0.81 P2RX7 (0.35) P2RX7DGAT1MAPK14
SCHEMBL15072587 0.77 DGAT1 (0.34) P2RX7SMN1; SMN2DGAT1ALDH1A1KDM4E
SCHEMBL15051315 0.77 DGAT1 (0.33) P2RX7SMN1; SMN2DGAT1MAPT
SCHEMBL15051765 0.74 DGAT1 (0.30) P2RX7DGAT1
SCHEMBL627420 0.71 PIK3C3 (0.33) P2RX7DGAT1MAPT
SCHEMBL15050992 0.71 SMN1; SMN2 (0.35) SMN1; SMN2MAPK14MAPT
SCHEMBL626741 0.70 P2RX7 (0.35) P2RX7DGAT1MAPTALDH1A1
SCHEMBL15051324 0.69 DGAT1 (0.32) DGAT1GAA
SCHEMBL15051049 0.68 KDM4E (0.36) SMN1; SMN2L3MBTL1MAPTALDH1A1KDM4E

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130165464-A1 HETEROARYLS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2013-06-27 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-20130165464-A1 HETEROARYLS AND USES THEREOF PIK3C2B, PI4KB, PIK3R4 P2RX7 1617/4885SMN1; SMN2 3783/4885L3MBTL1 866/4885

“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.