SCHEMBL3450328

SCHEMBL3450328

CC(C)(C)[Si](C)(C)n1cc(OBOc2cn([Si](C)(C)C(C)(C)C)c3ccccc23)c2ccccc21

nearest known ligand 0.31

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
POLB P06746 1/20 0.31
HPGD P15428 1/20 0.31
TSHR P16473 1/20 0.31
KMT2A Q03164 1/20 0.31
HSD17B10 Q99714 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
SCHEMBL5730271 0.77 PRMT5 (0.31)
SCHEMBL1752166 0.74 GPR3 (0.32) KDM4EMEN1ALDH1A1HPGDKMT2A
SCHEMBL1751841 0.74 GPR3 (0.32) KDM4EALDH1A1HPGD
SCHEMBL29957339 0.72 MAPT (0.32) KDM4EALDH1A1POLBHPGD
SCHEMBL3450325 0.72 MAPT (0.32) KDM4EALDH1A1POLBHPGD
SCHEMBL1606642 0.72 GPR84 (0.48) KDM4EALDH1A1POLBKMT2A
SCHEMBL30005815 0.65 GPR3 (0.44) KDM4EMEN1ALDH1A1POLBHPGD
SCHEMBL25738058 0.65 GPR3 (0.44) KDM4EMEN1ALDH1A1POLBHPGD
SCHEMBL1852437 0.64
SCHEMBL3334605 0.61 CDK4 (0.39)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1615898-B1 2-Aminopyrimidine derivatives and their medical use NOVARTIS AG (CH) 2014-10-29 EP disclosed
US-20100137313-A1 HETEROCYCLIC DERIVATIVES AND METHODS OF USE THEREOF ASTRAZENECA AB 2010-06-03 US disclosed
EP-1615898-A1 2-AMINOPYRIMIDINE DERIVATIVES AND THEIR MEDICAL USE Novartis AG (CH) 2006-01-18 EP disclosed
WO-2004089913-A1 AMINOPYRIMIDINE DERIVATIVES AND THEIR MEDICAL USE NOVARTIS AG (CH) 2004-10-21 WO 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-20100137313-A1 HETEROCYCLIC DERIVATIVES AND METHODS OF USE THEREOF SDHA, SDHB, UROD KDM4E 3882/4885MEN1 859/4885ALDH1A1 530/4885

“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.