SCHEMBL20186840

SCHEMBL20186840

O=S(=O)(NC1CC1)C1CNC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.46
CA7 P43166 3/20 0.46
CA14 Q9ULX7 3/20 0.46
CA1 P00915 2/20 0.36
APLNR P35414 2/20 0.34
CA2 P00918 1/20 0.33
JAK2 O60674 1/20 0.33
JAK1 P23458 1/20 0.33
JAK3 P52333 1/20 0.33
CA9 Q16790 1/20 0.32
KDM4E B2RXH2 1/20 0.30
RECQL P46063 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
PKM P14618 1/20 0.30
LMNA P02545 1/20 0.30
CYP3A4 P08684 1/20 0.30
GABRA1 P14867 1/20 0.30
TSHR P16473 1/20 0.30
GABRG2 P18507 1/20 0.30
NFKB1 P19838 1/20 0.30

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
SCHEMBL28414501 0.91 CA12 (0.43) CA12CA7CA14CA1APLNR
SCHEMBL28410020 0.91 CA12 (0.48) CA12CA7CA14CA1APLNR
SCHEMBL28413065 0.89 CA12 (0.52) CA12CA7CA14CA1APLNR
SCHEMBL21806108 0.80
SCHEMBL24773688 0.79 CA12 (0.55) CA12CA7CA14CA1CA2
SCHEMBL16364952 0.79 GABRA1 (0.48) CA12CA7CA14CA1CA2
SCHEMBL12970652 0.75 CA12 (0.50) CA12CA7CA14CA1CA2
SCHEMBL27994463 0.74 GABRA1 (0.43) CA12CA7CA14CA1CA2
Hydrochloric Acid SCHEMBL13386291 0.73 LMNA (0.41) CA12CA7CA14CA1CA2
SCHEMBL13580239 0.71 KCNH2 (0.41) CA12CA7CA14APLNRJAK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103524393-B Azetidine-3-sulfanilamide derivative and synthetic method thereof GUANGDONG HOSPITAL TRADITIONAL CHINESE MEDICINE 2015-01-07 CN claimed
CN-103524393-A Azetidine-3-sulfanilamide derivative and synthetic method thereof GUANGDONG HOSPITAL TRADITIONAL CHINESE MEDICINE 2014-01-22 CN claimed
EP-3548495-B1 PYRAZOLOPYRIMIDINE DERIVATIVES AS CAM KINASE INHIBITORS GILEAD SCIENCES INC (US) 2021-01-27 EP disclosed
CN-110914256-A Novel sulfonamide carboxamide compounds 英夫拉索姆有限公司 2020-03-24 CN disclosed
EP-3548495-A1 PYRAZOLOPYRIMIDINE DERIVATIVES AS CAM KINASE INHIBITORS Gilead Sciences, Inc. (US) 2019-10-09 EP disclosed
US-10100058-B2 Fused heterocyclic compounds as CaM kinase inhibitors GILEAD SCIENCES, INC. (US) 2018-10-16 US disclosed
WO-2018102384-A1 PYRAZOLOPYRIMIDINE DERIVATIVES AS CAM KINASE INHIBITORS GILEAD SCIENCES, INC. (US) 2018-06-07 WO disclosed
US-20180148457-A1 FUSED HETEROCYCLIC COMPOUNDS AS CAM KINASE INHIBITORS GILEAD SCIENCES, INC. 2018-05-31 US disclosed
CN-103524393-B Azetidine-3-sulfanilamide derivative and synthetic method thereof GUANGDONG HOSPITAL TRADITIONAL CHINESE MEDICINE 2015-01-07 CN disclosed
CN-103524393-A Azetidine-3-sulfanilamide derivative and synthetic method thereof GUANGDONG HOSPITAL TRADITIONAL CHINESE MEDICINE 2014-01-22 CN 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-10100058-B2 Fused heterocyclic compounds as CaM kinase inhibitors CAMK1, CAMKK1, CAMK1D CA12 2073/4885CA7 1379/4885CA14 2817/4885
US-20180148457-A1 FUSED HETEROCYCLIC COMPOUNDS AS CAM KINASE INHIBITORS CAMK1, CAMKK1, CAMK1D CA12 2073/4885CA7 1379/4885CA14 2817/4885

“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.