SCHEMBL6404124

SCHEMBL6404124

O=C(NCc1cc(-c2ccc(Cl)cc2)no1)c1ccccc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.69
SMN1; SMN2 Q16637 7/20 0.67
HTT P42858 4/20 0.67
ALDH1A1 P00352 3/20 0.67
L3MBTL1 Q9Y468 2/20 0.67
JAK2 O60674 1/20 0.67
LMNA P02545 2/20 0.65
CYP1A2 P05177 5/20 0.57
CYP2C19 P33261 4/20 0.57
MAPT P10636 3/20 0.57
CYP3A4 P08684 2/20 0.57
CYP2D6 P10635 2/20 0.57
GAA P10253 1/20 0.57
ROCK2 O75116 1/20 0.55
PRKCA P17252 1/20 0.55
GRK2 P25098 1/20 0.55
NOTUM Q6P988 2/20 0.55
KMT2A Q03164 5/20 0.54
RAB9A P51151 5/20 0.54
MEN1 O00255 4/20 0.54

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
SCHEMBL6403827 0.95 POLB (0.65) POLBSMN1; SMN2HTTALDH1A1L3MBTL1
SCHEMBL6404893 0.89 ROCK2 (0.56) POLBSMN1; SMN2HTTALDH1A1L3MBTL1
SCHEMBL6402512 0.88 ROCK2 (0.59) POLBSMN1; SMN2HTTALDH1A1L3MBTL1
SCHEMBL6409325 0.88 NPC1 (0.64) POLBSMN1; SMN2HTTALDH1A1L3MBTL1
SCHEMBL20810035 0.87 POLB (0.62) POLBSMN1; SMN2HTTALDH1A1L3MBTL1
SCHEMBL11495864 0.85 POLB (0.78) POLBSMN1; SMN2HTTALDH1A1L3MBTL1
SCHEMBL6405128 0.85 ROCK2 (0.56) POLBSMN1; SMN2HTTALDH1A1L3MBTL1
SCHEMBL6402577 0.84 SMN1; SMN2 (0.72) POLBSMN1; SMN2HTTALDH1A1L3MBTL1
SCHEMBL3025050 0.83 POLB (0.63) POLBSMN1; SMN2HTTALDH1A1L3MBTL1
SCHEMBL20810074 0.82 POLB (0.53) POLBSMN1; SMN2HTTALDH1A1L3MBTL1

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 POLB 3713/4885SMN1; SMN2 4458/4885HTT 483/4885

“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.