SCHEMBL6099994

SCHEMBL6099994

O=C(O)NC1CCN(C(=O)c2ccc(N3CCOCC3)nc2)CC1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.71
KDM4E B2RXH2 4/20 0.67
HPGD P15428 4/20 0.67
HSD17B10 Q99714 3/20 0.67
POLB P06746 1/20 0.67
ALOX15 P16050 1/20 0.67
ADRA1A P35348 3/20 0.59
HPGDS O60760 1/20 0.58
USP30 Q70CQ3 1/20 0.56
SFRP1 Q8N474 1/20 0.54
SMN1; SMN2 Q16637 2/20 0.50
MAPT P10636 3/20 0.49
CYP1A2 P05177 1/20 0.49
CYP2C19 P33261 1/20 0.49
LMNA P02545 2/20 0.48
GAA P10253 1/20 0.48
TSHR P16473 1/20 0.48
CASP1 P29466 1/20 0.48
HTT P42858 1/20 0.47
CXCR4 P61073 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
SCHEMBL4618663 0.83 ALDH1A1 (0.78) ALDH1A1KDM4EHPGDHSD17B10POLB
SCHEMBL29944351 0.80 HPGD (1.00) ALDH1A1KDM4EHPGDHSD17B10POLB
SCHEMBL4618652 0.79 ALDH1A1 (0.84) ALDH1A1KDM4EHPGDHSD17B10POLB
SCHEMBL13663056 0.79 EPHX2 (0.72)
SCHEMBL5223723 0.78 HRH3 (0.65) HPGDSUSP30HRH3
SCHEMBL4734136 0.78 EPHX2 (0.60) HPGDSFRP1SMN1; SMN2PRKAA2
SCHEMBL12143441 0.78 ALDH1A1 (0.73) ALDH1A1KDM4EHPGDHSD17B10POLB
SCHEMBL30635500 0.78 HPGD (0.90) ALDH1A1KDM4EHPGDHSD17B10POLB
SCHEMBL4618172 0.78 ALDH1A1 (0.64) ALDH1A1KDM4EHPGDHSD17B10POLB
SCHEMBL14119500 0.76 ALDH1A1 (0.55) ALDH1A1KDM4EHPGDHSD17B10POLB

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-20060276464-A1 Diarylsulfone sulfonamides and use thereof WYETH (US) 2006-12-07 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-20060276464-A1 Diarylsulfone sulfonamides and use thereof SFRP1, SOS1, FZD7 ALDH1A1 1865/4885KDM4E 3044/4885HPGD 2925/4885

“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.