SCHEMBL9986035

SCHEMBL9986035

Cc1c(OS(=O)(=O)c2ccccc2)c(=O)ccn1C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.41
KDM6A O15550 1/20 0.41
KDM4A O75164 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
KDM5C P41229 1/20 0.41
KDM2B Q8NHM5 1/20 0.41
DOHH Q9BU89 1/20 0.41
KDM2A Q9Y2K7 1/20 0.41
ALPL P05186 1/20 0.40
KMT2A Q03164 3/20 0.39
MEN1 O00255 2/20 0.39
ALDH1A1 P00352 7/20 0.39
MAPT P10636 4/20 0.39
XBP1 P17861 3/20 0.39
MPI P34949 3/20 0.39
NPSR1 Q6W5P4 3/20 0.39
TDP1 Q9NUW8 2/20 0.39
HSP90AA1 P07900 2/20 0.39
PARL Q9H300 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
SCHEMBL9986849 0.88 KDM4E (0.41) KDM4EKDM6AKDM4ACYP2C9CYP2C19
SCHEMBL9985651 0.82 ALPL (0.46) KDM4EKDM6AKDM4ACYP2C9CYP2C19
SCHEMBL15790433 0.71 CYP2C9 (0.53) KDM4EKDM6AKDM4ACYP2C9CYP2C19
SCHEMBL9986372 0.71 LMNA (0.54) KDM4EALPLKMT2AALDH1A1MAPT
SCHEMBL1286018 0.70 ALPL (0.48) ALPLALDH1A1MAPTXBP1MPI
SCHEMBL16744334 0.68 CYP2C9 (0.50) KDM4EKDM6AKDM4ACYP2C9CYP2C19
SCHEMBL9986769 0.68 CA12 (0.42) CYP2C9CYP2C19ALPLKMT2AMEN1
SCHEMBL17228664 0.67 CYP2C9 (0.48) KDM4EKDM6AKDM4ACYP2C9CYP2C19
SCHEMBL28115946 0.67 FFAR4 (0.51) ALPLALDH1A1MAPTXBP1MPI
SCHEMBL28229836 0.65 ALPL (0.47) ALPLALDH1A1MAPTXBP1MPI

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8889638-B2 Stimulus-triggered prodrugs THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2014-11-18 US disclosed
US-20110312905-A1 STIMULUS-TRIGGERED PRODRUGS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2011-12-22 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-20110312905-A1 STIMULUS-TRIGGERED PRODRUGS PREP, ADAM10, DNPEP KDM4E 3092/4885KDM6A 1995/4885KDM4A 1940/4885

“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.