SCHEMBL20092222

SCHEMBL20092222

Cn1cncc1-c1ccc(N)c(S(C)(=O)=O)c1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.46
SYK P43405 4/20 0.43
PRMT5 O14744 1/20 0.43
WDR77 Q9BQA1 1/20 0.43
GSK3B P49841 7/20 0.40
DYRK1A Q13627 7/20 0.40
WNT1 P04628 3/20 0.40
TYK2 P29597 4/20 0.40
HPGDS O60760 1/20 0.39
MMP2 P08253 1/20 0.39
MMP13 P45452 1/20 0.39
MMP14 P50281 1/20 0.39

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
SCHEMBL20092191 0.79 TYK2 (0.48) IDO1PRMT5WDR77GSK3BDYRK1A
SCHEMBL12492587 0.76 IDO1 (0.58) IDO1PRMT5WDR77GSK3BDYRK1A
SCHEMBL1431534 0.75 IDO1 (0.55) IDO1HPGDS
SCHEMBL15507182 0.75 ALDH1A1 (0.58) IDO1PRMT5WDR77TYK2HPGDS
SCHEMBL30132180 0.75 ALDH1A1 (0.58) IDO1PRMT5WDR77TYK2HPGDS
SCHEMBL21857535 0.74 KMT2A (0.56) IDO1PRMT5WDR77GSK3BDYRK1A
SCHEMBL19174931 0.74 IDO1 (0.51) IDO1PRMT5WDR77GSK3BDYRK1A
SCHEMBL20092319 0.74 IDO1 (0.48) IDO1PRMT5WDR77GSK3BDYRK1A
SCHEMBL20092109 0.72 SYK (0.48) SYKTYK2
SCHEMBL17785817 0.72 PIK3CD (0.47) PRMT5WDR77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4206196-A1 PYRIMIDINE SUBSTITUTED DERIVATIVES AS TYK2 INHIBITORS Almirall S.A. (ES) 2023-07-05 EP disclosed
US-20210094948-A1 TYK2 INHIBITORS AND USES THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2021-04-01 US disclosed
US-10647713-B2 TYK2 inhibitors and uses thereof NIMBUS LAKSHMI, INC. (US) 2020-05-12 US disclosed
US-20180134700-A1 TYK2 INHIBITORS AND USES THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2018-05-17 US disclosed
US-20180134700-A1 TYK2 INHIBITORS AND USES THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2018-05-17 US disclosed
WO-2018075937-A1 TYK2 INHIBITORS AND USES THEREOF NIMBUS LAKSHMI, INC. (US) 2018-04-26 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 (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-20210094948-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 IDO1 429/4885SYK 39/4885PRMT5 690/4885
US-20180134700-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 IDO1 429/4885SYK 39/4885PRMT5 690/4885
US-10647713-B2 TYK2 inhibitors and uses thereof TYK2, JAK2, JAK1 IDO1 429/4885SYK 39/4885PRMT5 690/4885

“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.