SCHEMBL6134508

SCHEMBL6134508

COCCCCCCCOc1ccc(C(=O)n2nnc3ccccc32)cc1

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGAM O43451 12/20 0.80
AMY1A P0DUB6 12/20 0.80
GAA P10253 12/20 0.80
SI P14410 12/20 0.80
MGAM2 Q2M2H8 12/20 0.80
F12 P00748 6/20 0.70
KMT2A Q03164 6/20 0.62
HPGD P15428 2/20 0.62
MAPT P10636 2/20 0.62
ALOX15 P16050 1/20 0.62
HSD17B10 Q99714 1/20 0.62
F2 P00734 1/20 0.58
SLC9A1 P19634 1/20 0.58
ALDH1A1 P00352 3/20 0.57
KDM4E B2RXH2 1/20 0.57
HTT P42858 1/20 0.57
NPSR1 Q6W5P4 1/20 0.57
MEN1 O00255 2/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
MIF P14174 1/20 0.50

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
SCHEMBL27482235 0.97 MGAM (0.76) MGAMAMY1AGAASIMGAM2
SCHEMBL27466934 0.92 MGAM (0.69) MGAMAMY1AGAASIMGAM2
SCHEMBL27481488 0.91 MGAM (0.67) MGAMAMY1AGAASIMGAM2
SCHEMBL27468359 0.91 MGAM (0.67) MGAMAMY1AGAASIMGAM2
SCHEMBL27482232 0.90 MGAM (0.66) MGAMAMY1AGAASIMGAM2
SCHEMBL27481100 0.86 MGAM (0.93) MGAMAMY1AGAASIMGAM2
SCHEMBL8780395 0.84 MGAM (0.73) MGAMAMY1AGAASIMGAM2
SCHEMBL27482234 0.84 MGAM (0.58) MGAMAMY1AGAASIMGAM2
SCHEMBL8780356 0.83 MGAM (0.78) MGAMAMY1AGAASIMGAM2
SCHEMBL27482532 0.83 MGAM (0.78) MGAMAMY1AGAASIMGAM2

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-20050261177-A1 Compound ASTELLAS PHARMA INC. (JP) 2005-11-24 US disclosed
EP-1366066-A2 CYCLOHEXAPEPTIDE HAVING ANTIMICROBIAL ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-12-03 EP disclosed
WO-2002072621-A2 CYCLOHEXAPEPTIDE HAVING ANTIMICROBIAL ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-09-19 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-20050261177-A1 Compound MANBA, MAN2B1, MAN2A1 MGAM 12/4885AMY1A 131/4885GAA 205/4885

“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.