SCHEMBL3588460

SCHEMBL3588460

COC(=O)Cc1ncn(CC(=O)OC(C)(C)C)c1C

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.38
F2 P00734 1/20 0.37
FPR2 P25090 4/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
POLB P06746 1/20 0.36
HDAC6 Q9UBN7 2/20 0.35
CCNE2 O96020 1/20 0.34
CCNE1 P24864 1/20 0.34
CDK2 P24941 1/20 0.34
KMT2A Q03164 1/20 0.34
JAK2 O60674 1/20 0.33
JAK1 P23458 1/20 0.33
JAK3 P52333 1/20 0.33
RIPK1 Q13546 1/20 0.32
RIPK3 Q9Y572 1/20 0.32
GAA P10253 1/20 0.32

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
SCHEMBL8498289 0.87 HDAC6 (0.40) SMN1; SMN2F2FPR2KDM4EALDH1A1
SCHEMBL13031346 0.83 CSNK2A2 (0.41) SMN1; SMN2KDM4EALDH1A1POLBHDAC6
SCHEMBL3582137 0.81 F2 (0.47) SMN1; SMN2F2FPR2KDM4EALDH1A1
SCHEMBL3584041 0.78 SMN1; SMN2 (0.47) SMN1; SMN2KDM4EALDH1A1POLBKMT2A
SCHEMBL3588862 0.73 ENPP2 (0.36) SMN1; SMN2FPR2KDM4EALDH1A1POLB
SCHEMBL31006001 0.71 KDM4E (0.37) SMN1; SMN2FPR2KDM4EALDH1A1KMT2A
SCHEMBL23410471 0.70 KDM4E (0.41) SMN1; SMN2F2FPR2KDM4EALDH1A1
SCHEMBL7455876 0.70 F2 (0.47) SMN1; SMN2F2FPR2KDM4EALDH1A1
SCHEMBL19468957 0.70 KDM4E (0.43) SMN1; SMN2F2FPR2KDM4EALDH1A1
SCHEMBL29427431 0.70 POLB (0.50) F2FPR2KDM4EALDH1A1POLB

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-20100286191-A1 2-Arylthiazole Derivatives as CXCR3 Receptor Modulators MERCK SHARP & DOHME CORP. 2010-11-11 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-20100286191-A1 2-Arylthiazole Derivatives as CXCR3 Receptor Modulators CXCR3, CXCR1, CXCR2 SMN1; SMN2 4711/4885F2 2697/4885FPR2 64/4885

“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.