SCHEMBL5244145

SCHEMBL5244145

CN1CCN(S(=O)(=O)c2ccc(Sc3cccc4cccnc34)c3nonc23)CC1

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.50
ALDH1A1 P00352 4/20 0.47
GAA P10253 1/20 0.47
TSHR P16473 1/20 0.46
GFER P55789 1/20 0.46
ALOX15 P16050 1/20 0.45
MAPK1 P28482 2/20 0.44
KMT2A Q03164 1/20 0.44
FABP1 P07148 6/20 0.44
PKM P14618 1/20 0.41
HTR6 P50406 1/20 0.41

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
SCHEMBL4787514 0.90 L3MBTL1 (0.52) L3MBTL1ALDH1A1GAATSHRGFER
SCHEMBL5242720 0.87 ALDH1A1 (0.67) L3MBTL1ALDH1A1GAATSHRALOX15
SCHEMBL5244216 0.87 KMT2A (0.47) L3MBTL1ALDH1A1MAPK1KMT2APKM
SCHEMBL4786255 0.86 L3MBTL1 (0.48) L3MBTL1ALDH1A1TSHRGFERALOX15
SCHEMBL5242949 0.86 ALDH1A1 (0.53) L3MBTL1ALDH1A1GAATSHRGFER
SCHEMBL4784036 0.85 TSHR (0.67) L3MBTL1ALDH1A1GAATSHRGFER
SCHEMBL4787536 0.85 ALDH1A1 (0.55) L3MBTL1ALDH1A1GAATSHRALOX15
SCHEMBL4785121 0.84 TSHR (0.54) L3MBTL1ALDH1A1GAATSHRGFER
SCHEMBL5244384 0.82 HSD11B1 (0.49) L3MBTL1ALDH1A1GAAALOX15FABP1
SCHEMBL4788589 0.82 PKLR (0.45) L3MBTL1ALDH1A1GAAMAPK1FABP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1758873-A1 UBIQUITIN LIGASE INHIBITORS Rigel Pharmaceuticals, Inc. (US) 2007-03-07 EP claimed
WO-2006002284-A1 UBIQUITIN LIGASE INHIBITORS RIGEL PHARMACEUTICALS, INC. (US) 2006-01-05 WO claimed
US-20050282818-A1 Ubiquitin ligase inhibitors RIGEL PHARMACEUTICALS, INC. (US) 2005-12-22 US claimed
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 L3MBTL1 2603/4885ALDH1A1 2627/4885GAA 488/4885

“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.