SCHEMBL20523657

SCHEMBL20523657

COc1cc(Br)cc(NS(=O)(=O)c2ccccc2)c1C

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
GAA P10253 4/20 0.49
HSD17B10 Q99714 3/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
KDM4E B2RXH2 1/20 0.49
ALDH1A1 P00352 2/20 0.49
ALOX15 P16050 2/20 0.49
BRD1 O95696 2/20 0.48
BRPF1 P55201 2/20 0.48
BRPF3 Q9ULD4 2/20 0.48
TP53 P04637 1/20 0.48
POLB P06746 1/20 0.48
MAPT P10636 1/20 0.48
ACLY P53396 1/20 0.48
MCOLN2 Q8IZK6 1/20 0.48
MCOLN3 Q8TDD5 1/20 0.48
MCOLN1 Q9GZU1 1/20 0.48
TSHR P16473 1/20 0.48

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
SCHEMBL20523654 0.80 ALDH1A1 (0.60) HPGDKMT2AKDM4EALDH1A1ACLY
SCHEMBL20523546 0.79 NR3C1 (0.41) MEN1KMT2AALDH1A1ACLYKEAP1
SCHEMBL21630351 0.79 PIK3CG (0.48) MEN1KMT2AALDH1A1TP53POLB
SCHEMBL8661244 0.77 MCOLN3 (0.58) HPGDL3MBTL1HSD17B10MEN1KMT2A
SCHEMBL3380247 0.76 POLB (0.68) HPGDL3MBTL1GAAMEN1KMT2A
SCHEMBL8752472 0.75 HPGD (0.65) HPGDL3MBTL1MEN1KMT2AALDH1A1
SCHEMBL20523604 0.75 MAPT (0.37) GAAKMT2AKDM4EBRD1BRPF1
SCHEMBL21630384 0.75 HPGD (0.46) HPGDL3MBTL1GAAHSD17B10MEN1
SCHEMBL18299289 0.74 FFAR4 (0.50) HPGDGAAHSD17B10MEN1KMT2A
SCHEMBL16235832 0.74 CCR4 (0.61) HPGDL3MBTL1MEN1KMT2AALDH1A1

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
US-11135209-B2 Compositions and methods for inhibiting protein kinases UNIVERSITY OF HOUSTON SYSTEM (US) 2021-10-05 US disclosed
EP-3600307-B1 COMPOSITIONS FOR USE IN METHODS OF INHIBITING PROTEIN KINASES UNIV HOUSTON SYSTEM (US) 2021-05-05 EP disclosed
EP-3600307-A1 COMPOSITIONS FOR USE IN METHODS OF INHIBITING PROTEIN KINASES University of Houston System (US) 2020-02-05 EP disclosed
US-20200030303-A1 COMPOSITIONS AND METHODS FOR INHIBITING PROTEIN KINASES UNIVERSITY OF HOUSTON SYSTEM (US) 2020-01-30 US disclosed
WO-2018183633-A1 COMPOSITIONS FOR USE IN METHODS OF INHIBITING PROTEIN KINASES UNIVERSITY OF HOUSTON SYSTEM (US) 2018-10-04 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 (2 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-11135209-B2 Compositions and methods for inhibiting protein kinases RIPK2, RIPK1, NOD2 HPGD 3853/4885L3MBTL1 3550/4885GAA 2352/4885
US-20200030303-A1 COMPOSITIONS AND METHODS FOR INHIBITING PROTEIN KINASES RIPK2, RIPK1, NOD2 HPGD 3853/4885L3MBTL1 3550/4885GAA 2352/4885

“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.