SCHEMBL20093239

SCHEMBL20093239

CS(=O)(=O)c1cc(B(O)O)ccc1N

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 2/20 0.50
L3MBTL1 Q9Y468 1/20 0.39
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
G6PD P11413 1/20 0.37
IDE P14735 1/20 0.37
CDC25B P30305 1/20 0.37
CA2 P00918 2/20 0.34
LPL P06858 1/20 0.34
LIPG Q9Y5X9 1/20 0.34
CA1 P00915 1/20 0.34
HTR6 P50406 1/20 0.32
GAA P10253 1/20 0.32

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
SCHEMBL4010773 0.79 ENPP2 (0.52) ENPP2L3MBTL1ALDH1A1CA2LPL
SCHEMBL19214301 0.78 ENPP2 (0.50) ENPP2CA2LPLLIPGCA1
SCHEMBL23852735 0.76 L3MBTL1 (0.53) ENPP2L3MBTL1ALDH1A1CA2LPL
SCHEMBL2553161 0.75 ENPP2 (0.47) ENPP2CA2LPLLIPGCA1
SCHEMBL20399722 0.74 ENPP2 (0.50) ENPP2L3MBTL1
SCHEMBL520332 0.74 ENPP2 (0.50) ENPP2L3MBTL1ALDH1A1CA2LPL
SCHEMBL9175606 0.74 L3MBTL1 (0.61) L3MBTL1KDM4EALDH1A1G6PDIDE
SCHEMBL20150187 0.72 CYP3A4 (0.50) L3MBTL1KDM4EALDH1A1G6PDIDE
SCHEMBL2908276 0.72 G6PD (0.60) ENPP2L3MBTL1KDM4EALDH1A1G6PD
SCHEMBL30908409 0.72 CYP3A4 (0.50) L3MBTL1KDM4EALDH1A1G6PDIDE

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-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 ENPP2 982/4885L3MBTL1 914/4885KDM4E 391/4885
US-20180134700-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 ENPP2 982/4885L3MBTL1 914/4885KDM4E 391/4885
US-10647713-B2 TYK2 inhibitors and uses thereof TYK2, JAK2, JAK1 ENPP2 982/4885L3MBTL1 914/4885KDM4E 391/4885

“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.