SCHEMBL6406596

SCHEMBL6406596

COc1ccc(C(=O)NCc2cc(C3CCOC3)no2)cc1

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.47
HPGD P15428 2/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
CYP1A2 P05177 1/20 0.47
RAB9A P51151 4/20 0.47
KMT2A Q03164 4/20 0.47
POLB P06746 2/20 0.47
ALDH1A1 P00352 5/20 0.45
HTT P42858 2/20 0.45
LMNA P02545 1/20 0.45
GAA P10253 2/20 0.45
NPC1 O15118 2/20 0.44
TSHR P16473 1/20 0.44
RECQL P46063 1/20 0.43
MEN1 O00255 2/20 0.42
SLC5A7 Q9GZV3 2/20 0.42
TDP1 Q9NUW8 1/20 0.42
MAPT P10636 1/20 0.42
KDM4E B2RXH2 1/20 0.41

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
SCHEMBL6407917 0.86 RAB9A (0.52) SMN1; SMN2HPGDL3MBTL1CYP1A2RAB9A
SCHEMBL6404219 0.79 ALDH1A1 (0.58) SMN1; SMN2HPGDL3MBTL1CYP1A2RAB9A
SCHEMBL6402396 0.77 SMN1; SMN2 (0.77) SMN1; SMN2HPGDL3MBTL1CYP1A2RAB9A
SCHEMBL6409982 0.76 KMT2A (0.53) SMN1; SMN2HPGDL3MBTL1CYP1A2RAB9A
SCHEMBL6403585 0.76 SMN1; SMN2 (0.55) SMN1; SMN2HPGDL3MBTL1CYP1A2RAB9A
SCHEMBL6405212 0.75 RAB9A (0.63) SMN1; SMN2HPGDL3MBTL1RAB9AKMT2A
SCHEMBL6407570 0.75 RAB9A (0.59) SMN1; SMN2L3MBTL1CYP1A2RAB9AKMT2A
SCHEMBL6404133 0.75 KMT2A (0.52) SMN1; SMN2HPGDL3MBTL1CYP1A2RAB9A
SCHEMBL6403186 0.75 KMT2A (0.53) SMN1; SMN2HPGDL3MBTL1CYP1A2RAB9A
SCHEMBL6407402 0.75 ALDH1A1 (0.54) SMN1; SMN2HPGDL3MBTL1CYP1A2RAB9A

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-20050171358-A1 Substituted isoxazole alkylamine derivative and agri-and horticultural fungicide SDS BIOTECH K.K. (JP) 2005-08-04 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-20050171358-A1 Substituted isoxazole alkylamine derivative and agri-and horticultural fungicide AHR, ERG28, CYP1A2 SMN1; SMN2 4458/4885HPGD 3244/4885L3MBTL1 607/4885

“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.