SCHEMBL10078877

SCHEMBL10078877

CC(C)(C)c1csc(NC(=O)C2CCCCC2)n1

nearest known ligand 0.92

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATAD2 Q6PL18 1/20 0.92
RAB9A P51151 11/20 0.68
SMN1; SMN2 Q16637 5/20 0.56
CNR2 P34972 1/20 0.53
NPC1 O15118 9/20 0.52
ALDH1A1 P00352 5/20 0.52
MAPK1 P28482 2/20 0.52
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
POLB P06746 1/20 0.52
TAS1R3 Q7RTX0 1/20 0.52
TAS1R1 Q7RTX1 1/20 0.52
TAS1R2 Q8TE23 1/20 0.52
TYR P14679 1/20 0.52
LMNA P02545 3/20 0.51
NPSR1 Q6W5P4 3/20 0.51
HPGD P15428 2/20 0.51
HSD17B10 Q99714 2/20 0.51
ALOX15 P16050 1/20 0.51
TSHR P16473 1/20 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
SCHEMBL78747 0.99 ATAD2 (0.94) ATAD2RAB9ASMN1; SMN2CNR2NPC1
SCHEMBL16771556 0.96 ATAD2 (1.00) ATAD2RAB9ASMN1; SMN2CNR2NPC1
SCHEMBL77715 0.93 ATAD2 (0.89) ATAD2RAB9ASMN1; SMN2CNR2NPC1
SCHEMBL27149772 0.86 ATAD2 (0.78) ATAD2RAB9ASMN1; SMN2CNR2NPC1
SCHEMBL10078905 0.82 ATAD2 (0.64) ATAD2RAB9ASMN1; SMN2CNR2NPC1
SCHEMBL14047503 0.81 ATAD2 (0.70) ATAD2RAB9ASMN1; SMN2CNR2NPC1
SCHEMBL29354384 0.81 RAB9A (1.00) ATAD2RAB9ASMN1; SMN2NPC1ALDH1A1
SCHEMBL10078899 0.81 ATAD2 (0.65) ATAD2RAB9ASMN1; SMN2CNR2NPC1
SCHEMBL9892888 0.79 ATAD2 (0.67) ATAD2RAB9ASMN1; SMN2CNR2NPC1
SCHEMBL2571465 0.79 ATAD2 (0.66) ATAD2RAB9ASMN1; SMN2CNR2NPC1

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
WO-2019046668-A1 AMIDE SUBSTITUTED THIAZOLES AS PROTEIN SECRETION INHIBITORS KEZAR LIFE SCIENCES (US) 2019-03-07 WO disclosed
US-8119645-B2 Fungicide hydroximoyl-tetrazole derivatives BAYER CROPSCIENCE AG (DE) 2012-02-21 US disclosed
US-20090291969-A1 Fungicide hydroximoyl-tetrazole derivatives BAYER CROPSCIENCE AG (DE) 2009-11-26 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-20090291969-A1 Fungicide hydroximoyl-tetrazole derivatives HAAO, HAO1, CYP51A1 ATAD2 2466/4885RAB9A 3411/4885SMN1; SMN2 4328/4885

“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.