SCHEMBL14246342

SCHEMBL14246342

C[Si](C)(C)CCOCN(COCC[Si](C)(C)C)c1cc([C@@H]2C[C@H]3CC[C@@H](C2)N3C(=O)O)nc2c(I)cnn12

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.32
HSD17B10 Q99714 1/20 0.32
ALDH1A1 P00352 1/20 0.30
MAPT P10636 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL2147629 1.00 KDM4E (0.32) KDM4EHSD17B10ALDH1A1MAPTSMN1; SMN2
SCHEMBL31379 0.93
SCHEMBL2148341 0.90 CHEK1 (0.32) KDM4EHSD17B10ALDH1A1MAPTSMN1; SMN2
SCHEMBL2148336 0.90 CHEK1 (0.32) KDM4EHSD17B10ALDH1A1MAPTSMN1; SMN2
SCHEMBL2147497 0.89 CHRM2 (0.34) KDM4EALDH1A1
SCHEMBL12461044 0.89 CHRM2 (0.34) KDM4EALDH1A1
SCHEMBL2147530 0.89 CHRM2 (0.34) KDM4EALDH1A1
SCHEMBL12460799 0.89 CHRM2 (0.34) KDM4EALDH1A1
SCHEMBL15807506 0.89 CHRM2 (0.34) KDM4EALDH1A1
SCHEMBL584379 0.87 KDM4E (0.34) KDM4EHSD17B10ALDH1A1MAPTSMN1; SMN2

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-9227971-B2 Pyrazolo[1,5-a]pyrimidine compounds as mTOR inhibitors MERCK SHARP & DOHME CORP. (US) 2016-01-05 US disclosed
US-20120322791-A1 PYRAZOLO[1,5-a]PYRIMIDINE COMPOUNDS AS mTOR INHIBITORS MERCK SHARP & DOHME LLC 2012-12-20 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-20120322791-A1 PYRAZOLO[1,5-a]PYRIMIDINE COMPOUNDS AS mTOR INHIBITORS MTOR, RICTOR, RPS6KA5 KDM4E 620/4885HSD17B10 4456/4885ALDH1A1 2634/4885

“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.