SCHEMBL5242913

SCHEMBL5242913

N#Cc1cccnc1N1CCN(S(=O)(=O)c2ccc(Cl)c3nonc23)CC1

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 4/20 0.57
DRD2 P14416 3/20 0.45
HTR2A P28223 3/20 0.45
KDM4E B2RXH2 4/20 0.44
ALDH1A1 P00352 4/20 0.44
TDP1 Q9NUW8 1/20 0.44
HTR1A P08908 1/20 0.44
HTR7 P34969 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
MAPT P10636 1/20 0.43
RECQL P46063 1/20 0.43
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA9 Q16790 1/20 0.42
GBA1 P04062 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
SCHEMBL4788475 0.86 KMT2A (0.57) HSD11B1KDM4EALDH1A1TDP1MEN1
SCHEMBL8160562 0.84 HSD11B1 (0.57) HSD11B1ALDH1A1TDP1MEN1KMT2A
SCHEMBL5244384 0.82 HSD11B1 (0.49) HSD11B1KDM4EALDH1A1TDP1
SCHEMBL5245000 0.81 SMN1; SMN2 (0.52) KDM4EALDH1A1TDP1MEN1KMT2A
SCHEMBL3220081 0.78 HSD11B1 (0.72) HSD11B1DRD2HTR2AKDM4EALDH1A1
SCHEMBL5243664 0.76 ALDH1A1 (0.61) ALDH1A1TDP1MEN1KMT2AMAPT
SCHEMBL5242616 0.73 HSD11B1 (0.47) HSD11B1DRD2HTR2AKDM4EALDH1A1
SCHEMBL5366762 0.73 HSD11B1 (0.65) HSD11B1DRD2HTR2AKDM4EALDH1A1
SCHEMBL5286887 0.72 POLB (0.56) ALDH1A1TDP1MEN1KMT2AMAPT
SCHEMBL5284517 0.71 HSD11B1 (0.62) HSD11B1

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 4 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

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 HSD11B1 3974/4885DRD2 4582/4885HTR2A 4451/4885

“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.