SCHEMBL3582565

SCHEMBL3582565

COC(=O)Cn1ccnc1CO

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 2/20 0.43
ALDH1A1 P00352 3/20 0.41
HTT P42858 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
ALPG P10696 2/20 0.40
PLAA Q9Y263 1/20 0.40
ALPL P05186 1/20 0.39
GAA P10253 1/20 0.36
KDM4E B2RXH2 3/20 0.36
KMT2A Q03164 1/20 0.36
HSD17B10 Q99714 1/20 0.35
KCNH2 Q12809 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
SCHEMBL13310544 0.83 FPR2 (0.40) FPR2ALDH1A1SMN1; SMN2ALPGPLAA
SCHEMBL25424436 0.80 AMPD2 (0.45) ALDH1A1HTTSMN1; SMN2KMT2A
SCHEMBL22356858 0.80 FPR2 (0.39) FPR2SMN1; SMN2ALPGPLAAALPL
SCHEMBL2960305 0.79 ALPL (0.50) ALDH1A1SMN1; SMN2ALPGPLAAALPL
SCHEMBL7896604 0.79 HSP90AA1 (0.45) FPR2ALDH1A1HTTSMN1; SMN2KDM4E
SCHEMBL3587986 0.79 FPR2 (0.49) FPR2ALDH1A1HTTSMN1; SMN2ALPG
SCHEMBL13010096 0.78 TLR8 (0.45) FPR2ALDH1A1HTTSMN1; SMN2GAA
SCHEMBL3594313 0.75 GFER (0.56) ALDH1A1SMN1; SMN2GAAKMT2A
SCHEMBL4963238 0.75 SMN1; SMN2 (0.40) FPR2ALDH1A1HTTSMN1; SMN2GAA
SCHEMBL3581846 0.74 SMN1; SMN2 (0.39) FPR2ALDH1A1HTTSMN1; SMN2GAA

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
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
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 FPR2 64/4885ALDH1A1 971/4885HTT 3557/4885

“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.