SCHEMBL6406598

SCHEMBL6406598

Cc1ccc(C(=O)NCc2cc(COc3ccccc3)no2)cc1

nearest known ligand 0.61

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.61
MAPK14 Q16539 2/20 0.51
POLB P06746 3/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
MDM2 Q00987 1/20 0.50
RAB9A P51151 3/20 0.49
NPC1 O15118 2/20 0.49
TSHR P16473 1/20 0.49
ATM Q13315 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
TDP1 Q9NUW8 2/20 0.49
ALDH1A1 P00352 2/20 0.47
RXFP1 Q9HBX9 1/20 0.47
HPGD P15428 1/20 0.45
NR1H4 Q96RI1 1/20 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
SCHEMBL6407914 0.92 RAB9A (0.48) LMNAMAPK14POLBSMN1; SMN2MDM2
SCHEMBL6405248 0.91 POLB (0.57) LMNAMAPK14POLBSMN1; SMN2MDM2
SCHEMBL6405537 0.90 NPC1 (0.54) LMNAPOLBSMN1; SMN2MDM2RAB9A
SCHEMBL6407567 0.90 KMT2A (0.55) LMNAPOLBSMN1; SMN2MDM2RAB9A
SCHEMBL6403186 0.85 KMT2A (0.53) LMNAPOLBSMN1; SMN2MDM2RAB9A
SCHEMBL6405096 0.84 NPC1 (0.50) LMNAPOLBSMN1; SMN2RAB9ANPC1
SCHEMBL6407948 0.83 BCHE (0.45) LMNAPOLBSMN1; SMN2MDM2RAB9A
SCHEMBL6403880 0.83 TDP1 (0.51) LMNAMAPK14POLBSMN1; SMN2RAB9A
SCHEMBL6405981 0.83 NPC1 (0.57) LMNASMN1; SMN2RAB9ANPC1MEN1
SCHEMBL6410547 0.82 NPC1 (0.55) LMNAMAPK14POLBSMN1; SMN2RAB9A

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 3019/4885MAPK14 2923/4885POLB 3713/4885

“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.