SCHEMBL3582673

SCHEMBL3582673

COC(=O)Cn1cnc(C)c1CO

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.46
POLB P06746 1/20 0.42
KMT2A Q03164 3/20 0.40
DYRK1A Q13627 1/20 0.37
KDM4E B2RXH2 3/20 0.37
ALDH1A1 P00352 2/20 0.37
TSHR P16473 1/20 0.36
BRCA1 P38398 1/20 0.36
F2 P00734 1/20 0.36
RXFP1 Q9HBX9 2/20 0.36
NPSR1 Q6W5P4 1/20 0.36
GAA P10253 1/20 0.35
MAPK1 P28482 1/20 0.35
HSD17B10 Q99714 1/20 0.35
CASP3 P42574 1/20 0.35

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
SCHEMBL7455876 0.83 F2 (0.47) SMN1; SMN2KMT2AKDM4EALDH1A1F2
SCHEMBL3579547 0.81 CSNK2A2 (0.42) POLBKMT2AKDM4EALDH1A1GAA
SCHEMBL3584041 0.79 SMN1; SMN2 (0.47) SMN1; SMN2POLBKMT2AKDM4EALDH1A1
SCHEMBL3582137 0.77 F2 (0.47) SMN1; SMN2POLBKMT2AKDM4EALDH1A1
SCHEMBL31332871 0.76 MEN1 (0.33) KMT2A
SCHEMBL859654 0.73 FDPS (0.35) ALDH1A1
SCHEMBL3875339 0.73 YTHDC1 (0.51) SMN1; SMN2GAA
SCHEMBL5657414 0.70 ADORA2A (0.38) SMN1; SMN2ALDH1A1
SCHEMBL11577563 0.70 KDM4E (0.64) SMN1; SMN2KDM4EALDH1A1TSHRMAPK1
SCHEMBL7407782 0.70 F2 (0.46) SMN1; SMN2KMT2AKDM4EALDH1A1F2

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 3 patents. 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
US-20100286191-A1 2-Arylthiazole Derivatives as CXCR3 Receptor Modulators MERCK SHARP & DOHME CORP. 2010-11-11 US disclosed
WO-2007070433-A2 2-ARYLTHIAZOLE DERIVATIVES AS CXCR3 RECEPTOR MODULATORS MERCK & CO., INC. (US) 2007-06-21 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-20100286191-A1 2-Arylthiazole Derivatives as CXCR3 Receptor Modulators CXCR3, CXCR1, CXCR2 SMN1; SMN2 4711/4885POLB 4548/4885KMT2A 3866/4885

“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.