SCHEMBL6403578

SCHEMBL6403578

Cc1ccc(C(=O)NCc2cc(-c3ccc(F)cc3)no2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.54
POLB P06746 2/20 0.53
SMN1; SMN2 Q16637 4/20 0.51
CYP1A2 P05177 1/20 0.51
LMNA P02545 3/20 0.50
MAPT P10636 4/20 0.49
ALDH1A1 P00352 2/20 0.49
HTT P42858 2/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
HDAC1 Q13547 2/20 0.49
KDM1A O60341 1/20 0.49
JAK2 O60674 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
RXFP1 Q9HBX9 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
NAMPT P43490 1/20 0.48
HDAC3 O15379 1/20 0.47

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
SCHEMBL6407970 0.94 POLB (0.59) POLBSMN1; SMN2CYP1A2LMNAMAPT
SCHEMBL6410101 0.89 POLB (0.54) POLBSMN1; SMN2CYP1A2LMNAMAPT
SCHEMBL6404127 0.89 POLB (0.54) POLBSMN1; SMN2CYP1A2LMNAMAPT
SCHEMBL6404351 0.88 SMN1; SMN2 (0.57) POLBSMN1; SMN2CYP1A2LMNAMAPT
SCHEMBL6403149 0.88 NPC1 (0.57) POLBSMN1; SMN2CYP1A2LMNAMAPT
SCHEMBL6409325 0.88 NPC1 (0.64) POLBSMN1; SMN2CYP1A2LMNAMAPT
SCHEMBL6403008 0.88 ALDH1A1 (0.54) EPHX2POLBSMN1; SMN2CYP1A2LMNA
SCHEMBL6407414 0.87 MAPT (0.47) EPHX2POLBSMN1; SMN2CYP1A2LMNA
SCHEMBL6409969 0.87 POLB (0.50) EPHX2POLBSMN1; SMN2CYP1A2LMNA
SCHEMBL6403802 0.87 ROCK2 (0.57) POLBSMN1; SMN2CYP1A2LMNAMAPT

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 EPHX2 2961/4885POLB 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.