SCHEMBL6857771

SCHEMBL6857771

CC(C)(C)c1ccc(NC(=O)CF)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.59
NPC1 O15118 3/20 0.59
RAB9A P51151 3/20 0.59
MEN1 O00255 2/20 0.59
KMT2A Q03164 2/20 0.59
MAPK1 P28482 2/20 0.59
MAPT P10636 1/20 0.59
XBP1 P17861 1/20 0.59
HTT P42858 1/20 0.59
TRPV1 Q8NER1 6/20 0.56
PDK1 Q15118 1/20 0.56
PDK2 Q15119 1/20 0.56
PDK3 Q15120 1/20 0.56
PDK4 Q16654 1/20 0.56
KIF11 P52732 1/20 0.54
NR1H4 Q96RI1 2/20 0.53
HDAC3 O15379 1/20 0.53
HDAC11 Q96DB2 1/20 0.53
HDAC8 Q9BY41 1/20 0.53
HDAC6 Q9UBN7 1/20 0.53

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
SCHEMBL12233865 0.83 MAPT (0.58) SMN1; SMN2NPC1RAB9AMEN1KMT2A
SCHEMBL9185912 0.83 EPHX2 (0.66) SMN1; SMN2NPC1RAB9AMEN1KMT2A
SCHEMBL12926858 0.82 NPC1 (0.56) SMN1; SMN2NPC1RAB9AMEN1KMT2A
SCHEMBL8288211 0.81 NPC1 (0.54) SMN1; SMN2NPC1RAB9AMEN1KMT2A
SCHEMBL3043118 0.81 NPC1 (0.54) SMN1; SMN2NPC1RAB9AMEN1KMT2A
SCHEMBL13167576 0.81 RAB9A (0.65) SMN1; SMN2NPC1RAB9AMEN1KMT2A
SCHEMBL7098017 0.81 NPC1 (0.58) SMN1; SMN2NPC1RAB9AMEN1KMT2A
SCHEMBL19240371 0.81 KIF11 (0.59) SMN1; SMN2NPC1RAB9AMEN1KMT2A
SCHEMBL9429422 0.81 MAPT (0.59) SMN1; SMN2NPC1RAB9AMEN1KMT2A
SCHEMBL13650830 0.81 NR1H4 (0.58) SMN1; SMN2NPC1RAB9AMEN1KMT2A

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-6787557-B2 2,3-dimethyl-6-t-butyl-8-fluoro-4-hydroxyquinoline or ester derivatives; plant fungicides; Pyricularia MEIJI SEIKA KAISHA, LTD. (JP) 2004-09-07 US disclosed
US-20030176459-A1 Rice blast control agents MEIJI SEIKA PHARMA CO., LTD. (JP) 2003-09-18 US disclosed
EP-1291344-A1 RICE BLAST CONTROL AGENTS MEIJI SEIKA KAISHA LTD. (JP) 2003-03-12 EP 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-20030176459-A1 Rice blast control agents CNOT1, OSR1, RER1 SMN1; SMN2 3409/4885NPC1 619/4885RAB9A 452/4885

“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.