SCHEMBL22280430

SCHEMBL22280430

O=[N+]([O-])c1ccc(Cl)nc1SCc1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.62
KMT2A Q03164 1/20 0.62
TXNRD1 Q16881 2/20 0.54
GSR P00390 1/20 0.54
ALDH1A1 P00352 4/20 0.52
GSTP1 P09211 1/20 0.50
GSTM2 P28161 1/20 0.50
PIN1 Q13526 3/20 0.46
EGFR P00533 1/20 0.45
MAPT P10636 4/20 0.44
LMNA P02545 1/20 0.44
CTSB P07858 2/20 0.44
L3MBTL1 Q9Y468 1/20 0.43
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
HPGD P15428 1/20 0.41
CYP2C19 P33261 1/20 0.41
SLC29A1 Q99808 1/20 0.41
HTT P42858 1/20 0.41
POLB P06746 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
SCHEMBL22280411 0.86 MEN1 (0.62) MEN1KMT2ATXNRD1GSRALDH1A1
SCHEMBL15688471 0.83 MERTK (0.57) MEN1KMT2ATXNRD1ALDH1A1MAPT
SCHEMBL20476789 0.80 MEN1 (0.58) MEN1KMT2ATXNRD1ALDH1A1GSTP1
SCHEMBL22264083 0.80 MEN1 (0.58) MEN1KMT2ATXNRD1ALDH1A1GSTP1
SCHEMBL2272996 0.79 MAPT (0.48) MEN1KMT2ATXNRD1GSRALDH1A1
SCHEMBL18508428 0.78 MEN1 (0.51) MEN1KMT2ATXNRD1GSRGSTP1
SCHEMBL30498938 0.77 MEN1 (1.00) MEN1KMT2AALDH1A1GSTP1GSTM2
SCHEMBL393514 0.77 MEN1 (1.00) MEN1KMT2AALDH1A1GSTP1GSTM2
SCHEMBL15227162 0.75 MEN1 (0.63) MEN1KMT2AALDH1A1GSTP1GSTM2
SCHEMBL10514409 0.75 TXNRD1 (0.58) MEN1KMT2ATXNRD1GSRALDH1A1

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
US-20220119348-A1 HYDROCARBYLSULFONYL-SUBSTITUTED PYRIDINES AND THEIR USE IN THE TREATMENT OF CANCER OBLIQUE THERAPEUTICS AB (SE) 2022-04-21 US disclosed
US-11161815-B2 Hydrocarbylsulfonyl-substituted pyridines and their use in the treatment of cancer OBLIQUE THERAPEUTICS AB (SE) 2021-11-02 US disclosed
US-20200239417-A1 HYDROCARBYLSULFONYL-SUBSTITUTED PYRIDINES AND THEIR USE IN THE TREATMENT OF CANCER OBLIQUE THERAPEUTICS AB (SE) 2020-07-30 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 (3 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-20200239417-A1 HYDROCARBYLSULFONYL-SUBSTITUTED PYRIDINES AND THEIR USE IN THE TREATMENT OF CANCER HCCS, ABL1, IDH1 MEN1 692/4885KMT2A 265/4885TXNRD1 549/4885
US-20220119348-A1 HYDROCARBYLSULFONYL-SUBSTITUTED PYRIDINES AND THEIR USE IN THE TREATMENT OF CANCER HCCS, ABL1, IDH1 MEN1 692/4885KMT2A 265/4885TXNRD1 549/4885
US-11161815-B2 Hydrocarbylsulfonyl-substituted pyridines and their use in the treatment of cancer HCCS, ABL1, IDH1 MEN1 692/4885KMT2A 265/4885TXNRD1 549/4885

“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.