SCHEMBL6408017

SCHEMBL6408017

CC(C)c1cc(CNC(=O)C(C)c2ccccc2)on1

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.53
ATM Q13315 1/20 0.53
ERCC1 P07992 1/20 0.51
ERCC4 Q92889 1/20 0.51
EPHX2 P34913 1/20 0.51
LIPC P11150 2/20 0.51
LIPG Q9Y5X9 2/20 0.51
GABRA5 P31644 1/20 0.48
SLC5A7 Q9GZV3 3/20 0.45
LMNA P02545 2/20 0.44
RAB9A P51151 3/20 0.44
NPC1 O15118 2/20 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 0.84 LMNA (0.61) SMN1; SMN2ERCC1ERCC4LMNA
SCHEMBL6407440 0.80 EPHX2 (0.57) SMN1; SMN2ATMEPHX2LIPCLIPG
SCHEMBL6410124 0.79 SMN1; SMN2 (0.52) SMN1; SMN2ATMEPHX2LIPCLIPG
SCHEMBL6403571 0.76 SLC5A7 (0.48) SMN1; SMN2ATMEPHX2GABRA5SLC5A7
SCHEMBL28946362 0.73 ERCC1 (0.70) ERCC1ERCC4
SCHEMBL5804315 0.73 ERCC1 (0.70) ERCC1ERCC4
SCHEMBL9548380 0.70 SMN1; SMN2 (0.46) SMN1; SMN2ATMEPHX2LMNARAB9A
SCHEMBL6402251 0.69 NPC1 (0.54) SMN1; SMN2EPHX2GABRA5SLC5A7LMNA
SCHEMBL10138151 0.69 PKM (0.58) ERCC1ERCC4LMNA
SCHEMBL19523017 0.69 PKM (0.58) ERCC1ERCC4LMNA

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 SMN1; SMN2 4458/4885ATM 1728/4885ERCC1 3109/4885

“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.