SCHEMBL20150832

SCHEMBL20150832

CCNC(=O)n1nnc2ccccc21

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ASAH1 Q13510 2/20 0.71
MGLL Q99685 1/20 0.57
GAA P10253 11/20 0.54
MGAM O43451 10/20 0.54
AMY1A P0DUB6 10/20 0.54
SI P14410 10/20 0.54
MGAM2 Q2M2H8 10/20 0.54
KMT2A Q03164 3/20 0.54
F2 P00734 2/20 0.54
HPGD P15428 1/20 0.54
SLC9A1 P19634 1/20 0.54
HTT P42858 2/20 0.52
NPSR1 Q6W5P4 2/20 0.52
MITF O75030 1/20 0.52
LMNA P02545 1/20 0.52
TSHR P16473 1/20 0.52
MAPK1 P28482 1/20 0.52
HSD17B10 Q99714 1/20 0.52
DGAT1 O75907 1/20 0.51
ALDH1A1 P00352 2/20 0.51

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
SCHEMBL424357 0.83 ASAH1 (1.00) ASAH1MGLLGAAMGAMAMY1A
SCHEMBL13875221 0.83 ASAH1 (1.00) ASAH1MGLLGAAMGAMAMY1A
SCHEMBL12593863 0.83 ASAH1 (1.00) ASAH1MGLLGAAMGAMAMY1A
SCHEMBL8221643 0.83 ASAH1 (0.64) ASAH1MGLLGAAMGAMAMY1A
SCHEMBL17875212 0.82 ASAH1 (0.59) ASAH1MGLLGAAMGAMAMY1A
SCHEMBL8221504 0.82 ASAH1 (0.60) ASAH1MGLLGAAMGAMAMY1A
SCHEMBL427517 0.82 ASAH1 (0.70) ASAH1MGLLGAAMGAMAMY1A
SCHEMBL20150834 0.81 ASAH1 (0.60) ASAH1MGLLGAAMGAMAMY1A
SCHEMBL12593869 0.80 ASAH1 (0.58) ASAH1MGLLGAAMGAMAMY1A
SCHEMBL12593855 0.80 ASAH1 (0.62) ASAH1MGLLGAAMGAMAMY1A

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-20180134871-A1 ADDITION-CURABLE SILICONE RUBBER COMPOSITION AND CURED PRODUCT SHIN-ETSU CHEMICAL CO., LTD. (JP) 2018-05-17 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-20180134871-A1 ADDITION-CURABLE SILICONE RUBBER COMPOSITION AND CURED PRODUCT TST, SUGT1, RAD51 ASAH1 4108/4885MGLL 2882/4885GAA 2078/4885

“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.