SCHEMBL6409336

SCHEMBL6409336

O=C(O)N(Cc1cc(-c2ccc(Cl)cc2)no1)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 4/20 0.55
SMN1; SMN2 Q16637 7/20 0.54
RAB9A P51151 6/20 0.54
MEN1 O00255 5/20 0.54
KMT2A Q03164 5/20 0.54
NPC1 O15118 5/20 0.54
HTT P42858 3/20 0.54
L3MBTL1 Q9Y468 4/20 0.53
POLB P06746 1/20 0.52
JAK2 O60674 1/20 0.51
ALDH1A1 P00352 1/20 0.51
CYP1A2 P05177 4/20 0.50
CYP2C19 P33261 4/20 0.50
CYP2C9 P11712 2/20 0.50
TDP1 Q9NUW8 2/20 0.50
LMNA P02545 1/20 0.49
MAPT P10636 5/20 0.48
CYP3A4 P08684 2/20 0.48
CYP2D6 P10635 2/20 0.48
GAA P10253 1/20 0.48

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
SCHEMBL6408613 0.88 NOTUM (0.55) NOTUMSMN1; SMN2RAB9AMEN1KMT2A
SCHEMBL6403916 0.88 NPC1 (0.50) NOTUMSMN1; SMN2RAB9AMEN1KMT2A
SCHEMBL6409980 0.88 RAB9A (0.48) NOTUMSMN1; SMN2RAB9AMEN1KMT2A
SCHEMBL6402481 0.84 HPGD (0.59) SMN1; SMN2RAB9AMEN1KMT2ANPC1
SCHEMBL6408092 0.82 CHRNB2 (0.55) SMN1; SMN2RAB9AMEN1KMT2ANPC1
SCHEMBL6434804 0.80 CA12 (0.44) NOTUMSMN1; SMN2RAB9AMEN1KMT2A
SCHEMBL6404913 0.78 ALDH1A1 (0.43) NOTUMSMN1; SMN2RAB9AMEN1KMT2A
SCHEMBL6402371 0.77 CA12 (0.45) SMN1; SMN2RAB9AMEN1KMT2ANPC1
SCHEMBL27729677 0.76 NOTUM (0.67) NOTUMSMN1; SMN2RAB9AMEN1KMT2A
SCHEMBL4242009 0.73 NPC1 (0.59) SMN1; SMN2RAB9AMEN1KMT2ANPC1

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 NOTUM 755/4885SMN1; SMN2 4458/4885RAB9A 4044/4885

“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.