SCHEMBL6406637

SCHEMBL6406637

O=C(NCc1cc(-c2ccccc2)no1)C(Cl)c1ccccc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.58
POLB P06746 2/20 0.52
SMN1; SMN2 Q16637 7/20 0.51
ALDH1A1 P00352 3/20 0.51
HTT P42858 2/20 0.51
L3MBTL1 Q9Y468 2/20 0.51
JAK2 O60674 1/20 0.51
NOTUM Q6P988 2/20 0.50
CYP1A2 P05177 2/20 0.48
MAPT P10636 2/20 0.48
CYP3A4 P08684 1/20 0.48
GAA P10253 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C19 P33261 1/20 0.48
MMP2 P08253 1/20 0.45
MMP8 P22894 1/20 0.45
MMP12 P39900 1/20 0.45
HPGD P15428 1/20 0.44
NPC1 O15118 3/20 0.44
RAB9A P51151 3/20 0.44

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
SCHEMBL6405901 0.85 LMNA (0.61) LMNAPOLBSMN1; SMN2ALDH1A1HTT
SCHEMBL6401623 0.81 NOTUM (0.61) LMNAPOLBSMN1; SMN2ALDH1A1HTT
SCHEMBL23451628 0.79 POLB (0.75) LMNAPOLBSMN1; SMN2ALDH1A1HTT
SCHEMBL31686338 0.79 NOTUM (0.58) LMNAPOLBSMN1; SMN2ALDH1A1HTT
SCHEMBL6405895 0.78 ALDH1A1 (0.57) LMNAPOLBSMN1; SMN2ALDH1A1HTT
SCHEMBL6408080 0.76 TACR3 (0.48) LMNAPOLBSMN1; SMN2ALDH1A1HTT
SCHEMBL6410100 0.76 HTT (0.57) LMNAPOLBSMN1; SMN2ALDH1A1HTT
SCHEMBL6409331 0.75 ALDH1A1 (0.57) LMNAPOLBSMN1; SMN2ALDH1A1HTT
SCHEMBL31124145 0.75 NOTUM (0.54) LMNAPOLBSMN1; SMN2ALDH1A1HTT
SCHEMBL6404369 0.75 SMN1; SMN2 (0.56) LMNAPOLBSMN1; SMN2ALDH1A1HTT

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 LMNA 3019/4885POLB 3713/4885SMN1; SMN2 4458/4885

“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.