SCHEMBL20156704

SCHEMBL20156704

CC(CC(C)(C)C)NC(=O)n1nnc2ccccc21

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ASAH1 Q13510 2/20 0.51
FAAH O00519 1/20 0.46
GAA P10253 8/20 0.46
MGAM O43451 7/20 0.46
AMY1A P0DUB6 7/20 0.46
SI P14410 7/20 0.46
MGAM2 Q2M2H8 7/20 0.46
KMT2A Q03164 3/20 0.46
F2 P00734 2/20 0.46
HPGD P15428 1/20 0.46
SLC9A1 P19634 1/20 0.46
MGLL Q99685 1/20 0.45
APAF1 O14727 1/20 0.44
POLB P06746 1/20 0.44
NPSR1 Q6W5P4 3/20 0.44
MAPT P10636 2/20 0.44
DGAT1 O75907 1/20 0.43
HTT P42858 2/20 0.43
ALDH1A1 P00352 2/20 0.43
KDM4E B2RXH2 1/20 0.43

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
SCHEMBL20928041 0.84 ASAH1 (0.53) ASAH1FAAHGAAMGAMAMY1A
SCHEMBL22101596 0.82 ASAH1 (0.56) ASAH1FAAHGAAMGAMAMY1A
SCHEMBL21183226 0.80 ASAH1 (0.51) ASAH1FAAHGAAMGAMAMY1A
SCHEMBL12648230 0.77 FAAH (0.53) ASAH1FAAHGAAMGAMAMY1A
SCHEMBL12648519 0.77 FAAH (0.53) ASAH1FAAHGAAMGAMAMY1A
SCHEMBL22649182 0.77 ASAH1 (0.51) ASAH1FAAHGAAMGAMAMY1A
SCHEMBL20664729 0.76 ASAH1 (0.56) ASAH1GAAMGAMAMY1ASI
SCHEMBL17875212 0.74 ASAH1 (0.59) ASAH1GAAMGAMAMY1ASI
SCHEMBL14300892 0.74 GAA (0.54) ASAH1FAAHGAAMGAMAMY1A
SCHEMBL20150832 0.74 ASAH1 (0.71) ASAH1GAAMGAMAMY1ASI

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10544281-B2 Addition-curable silicone rubber composition and cured product SHIN-ETSU CHEMICAL CO., LTD. (JP) 2020-01-28 US disclosed
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 (2 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-10544281-B2 Addition-curable silicone rubber composition and cured product TST, SUGT1, RAD51 ASAH1 4108/4885FAAH 3972/4885GAA 2078/4885
US-20180134871-A1 ADDITION-CURABLE SILICONE RUBBER COMPOSITION AND CURED PRODUCT TST, SUGT1, RAD51 ASAH1 4108/4885FAAH 3972/4885GAA 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.