SCHEMBL6392185

SCHEMBL6392185

O=S(=O)(Nc1ccc(Oc2cccc3cccnc23)c2nonc12)N1CCN(c2ccccc2)CC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.50
GAA P10253 2/20 0.50
HTT P42858 4/20 0.46
POLB P06746 1/20 0.46
ALOX15 P16050 2/20 0.41
MAPT P10636 3/20 0.40
GFER P55789 1/20 0.39
SLC40A1 Q9NP59 5/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
SCN5A Q14524 1/20 0.38
SCN9A Q15858 1/20 0.38
BCL2 P10415 1/20 0.38
BCL2L1 Q07817 1/20 0.38
MCL1 Q07820 1/20 0.38
BCL2A1 Q16548 1/20 0.38
METAP2 P50579 2/20 0.38
METAP1 P53582 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
G6PD P11413 1/20 0.38
NFKBIA P25963 1/20 0.38

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
SCHEMBL4745405 0.84 ALDH1A1 (0.67) ALDH1A1GAAHTTPOLBALOX15
SCHEMBL2961832 0.68 ALDH1A1 (1.00) ALDH1A1GAAHTTPOLBALOX15
SCHEMBL30925488 0.68 GLO1 (0.59) ALDH1A1HTTALOX15MAPTSLC40A1
SCHEMBL27214310 0.68 GLO1 (0.59) ALDH1A1HTTALOX15MAPTSLC40A1
SCHEMBL27214198 0.67 TDP1 (0.67) ALDH1A1HTTALOX15MAPTSLC40A1
SCHEMBL5242720 0.67 ALDH1A1 (0.67) ALDH1A1GAAHTTPOLBALOX15
SCHEMBL8151855 0.67 ALDH1A1 (0.55) ALDH1A1GAAHTTPOLBALOX15
SCHEMBL8268556 0.66 ALDH1A1 (0.52) ALDH1A1GAAHTTPOLBALOX15
SCHEMBL6392848 0.65 ALDH1A1 (0.55) ALDH1A1GAAHTTMAPTNPSR1
SCHEMBL4386263 0.63 KDM4E (0.72) ALDH1A1GAAHTTALOX15MAPT

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008115259-A2 DERIVATIVES OF BENZOXADIAZOLE SUITABLE FOR THE TREATMENT OF CELL PROLIFERATIVE DISEASES RIGEL PHARMACEUTICALS, INC. (US) 2008-09-25 WO disclosed
WO-2006002284-A1 UBIQUITIN LIGASE INHIBITORS RIGEL PHARMACEUTICALS, INC. (US) 2006-01-05 WO disclosed
US-20050282818-A1 Ubiquitin ligase inhibitors RIGEL PHARMACEUTICALS, INC. (US) 2005-12-22 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-20050282818-A1 Ubiquitin ligase inhibitors NEDD4, TRAF6, XIAP ALDH1A1 2627/4885GAA 488/4885HTT 722/4885

“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.