SCHEMBL5284546

SCHEMBL5284546

O=S(=O)(c1cccc2nsnc12)N1CCC(Oc2ccccc2C(F)(F)F)CC1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.56
ALDH1A1 P00352 4/20 0.56
LMNA P02545 4/20 0.56
CYP2C19 P33261 3/20 0.56
CYP1A2 P05177 2/20 0.56
CYP2C9 P11712 2/20 0.56
MEN1 O00255 2/20 0.56
MAPT P10636 3/20 0.54
GAA P10253 3/20 0.54
SMN1; SMN2 Q16637 6/20 0.53
USP2 O75604 3/20 0.53
POLB P06746 1/20 0.53
MAPK1 P28482 2/20 0.52
HPGD P15428 1/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2D6 P10635 1/20 0.50
TDP1 Q9NUW8 1/20 0.49

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
SCHEMBL1471602 0.83 KMT2A (0.65) KMT2ALMNAMEN1SMN1; SMN2
SCHEMBL5283007 0.77 SCD (0.45) KMT2AMEN1
SCHEMBL5289213 0.77 SCD (0.48) KMT2AMEN1MAPT
SCHEMBL1471495 0.73 TP53 (0.62) KMT2ALMNACYP2C19CYP1A2MEN1
SCHEMBL3222938 0.73 MEN1 (0.63) KMT2AALDH1A1LMNACYP2C19CYP2C9
SCHEMBL6685830 0.72 UTS2R (0.63) KMT2AALDH1A1LMNAMEN1MAPT
SCHEMBL1471706 0.72 HSD11B1 (0.54) KMT2AALDH1A1MEN1SMN1; SMN2
SCHEMBL3223105 0.71 KMT2A (0.60) KMT2AALDH1A1LMNAMEN1GAA
SCHEMBL5244612 0.71 NPC1 (0.53) KMT2AMAPT
SCHEMBL6985771 0.71 KMT2A (0.79) KMT2AALDH1A1LMNACYP2C19CYP1A2

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
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 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 KMT2A 1303/4885ALDH1A1 2627/4885LMNA 3860/4885

“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.