SCHEMBL5425664

SCHEMBL5425664

CC(C)(C)OC(=O)N1CCCC(c2cc(-c3c(O)cccc3O)nc(N)n2)C1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMARCA2 P51531 2/20 0.44
SMARCA4 P51532 2/20 0.44
PBRM1 Q86U86 2/20 0.44
PRMT5 O14744 2/20 0.44
TRPV3 Q8NET8 1/20 0.43
USP30 Q70CQ3 2/20 0.43
ALOX5AP P20292 2/20 0.42
FEN1 P39748 2/20 0.42
HPGDS O60760 1/20 0.42
MAP3K12 Q12852 2/20 0.42
HSD11B1 P28845 1/20 0.42
PARP1 P09874 1/20 0.42
JAK2 O60674 1/20 0.40
JAK1 P23458 1/20 0.40
HSP90AA1 P07900 1/20 0.39
HSP90AB1 P08238 1/20 0.39

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
SCHEMBL5422694 0.93 PRMT5 (0.42) SMARCA2SMARCA4PBRM1PRMT5TRPV3
SCHEMBL5427341 0.91 SMARCA2 (0.40) SMARCA2SMARCA4PBRM1PRMT5TRPV3
SCHEMBL5432419 0.90 IKBKB (0.44) SMARCA2SMARCA4PBRM1PRMT5TRPV3
SCHEMBL5427237 0.90 SMARCA2 (0.53) SMARCA2SMARCA4PBRM1PRMT5TRPV3
SCHEMBL5429334 0.90 USP30 (0.41) SMARCA2SMARCA4PBRM1PRMT5TRPV3
SCHEMBL5426125 0.89 TRPV3 (0.45) SMARCA2SMARCA4PBRM1PRMT5TRPV3
SCHEMBL5427548 0.88 PRMT5 (0.41) SMARCA2SMARCA4PBRM1PRMT5TRPV3
SCHEMBL5428318 0.88 ALOX5AP (0.41) SMARCA2SMARCA4PBRM1PRMT5TRPV3
SCHEMBL5424220 0.88 PRMT5 (0.51) PRMT5USP30ALOX5APFEN1HPGDS
SCHEMBL5424194 0.87 CCNT1 (0.45) SMARCA2SMARCA4PBRM1PRMT5TRPV3

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-20070265289-A1 2-Aminopyrimidine Derivative ASTELLAS PHARMA INC. (JP) 2007-11-15 US disclosed
EP-1736472-A1 2-AMINOPYRIDINE DERIVATIVE Astellas Pharma Inc. (JP) 2006-12-27 EP 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-20070265289-A1 2-Aminopyrimidine Derivative NFKBIA, IKBKG, NFKB2 SMARCA2 3310/4885SMARCA4 3985/4885PBRM1 1539/4885

“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.