SCHEMBL6409949

SCHEMBL6409949

Cc1cc(CNC(=O)NC2CCCCC2)on1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.57
SMN1; SMN2 Q16637 6/20 0.54
RAB9A P51151 5/20 0.54
HPGD P15428 4/20 0.54
EPHX1 P07099 4/20 0.51
MAPT P10636 1/20 0.51
NPC1 O15118 3/20 0.50
ALDH1A1 P00352 1/20 0.50
POLB P06746 3/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
HTT P42858 2/20 0.47
NPSR1 Q6W5P4 1/20 0.46
RXFP1 Q9HBX9 1/20 0.46

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
SCHEMBL6402627 0.84 EPHX1 (0.51) EPHX2SMN1; SMN2RAB9AHPGDEPHX1
SCHEMBL6409359 0.84 RAB9A (0.59) SMN1; SMN2RAB9AHPGDEPHX1MAPT
SCHEMBL6403203 0.84 EPHX2 (0.61) EPHX2SMN1; SMN2RAB9AHPGDEPHX1
SCHEMBL6404969 0.83 EPHX1 (0.50) EPHX2SMN1; SMN2RAB9AHPGDEPHX1
SCHEMBL6406584 0.83 EPHX1 (0.50) EPHX2SMN1; SMN2RAB9AHPGDEPHX1
SCHEMBL6407673 0.83 EPHX1 (0.50) EPHX2SMN1; SMN2RAB9AHPGDEPHX1
SCHEMBL6405207 0.83 SMN1; SMN2 (0.47) EPHX2SMN1; SMN2RAB9AHPGDEPHX1
SCHEMBL6404204 0.83 RAB9A (0.50) EPHX2SMN1; SMN2RAB9AHPGDEPHX1
SCHEMBL6402421 0.82 RAB9A (0.59) EPHX2SMN1; SMN2RAB9AHPGDEPHX1
SCHEMBL6407578 0.82 EPHX1 (0.48) EPHX2SMN1; SMN2RAB9AHPGDEPHX1

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 2961/4885SMN1; SMN2 4458/4885RAB9A 4044/4885

“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.