SCHEMBL14543727

SCHEMBL14543727

CC1CCCN(S(C)(=O)=O)CC1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.52
MEN1 O00255 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
ALDH1A1 P00352 3/20 0.51
KDM4E B2RXH2 2/20 0.51
TP53 P04637 1/20 0.44
LMNA P02545 3/20 0.43
FABP6 P51161 1/20 0.43
POLB P06746 1/20 0.42
TSHR P16473 2/20 0.41
ACHE P22303 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
MAPK1 P28482 1/20 0.39
MCOLN3 Q8TDD5 1/20 0.39
ATM Q13315 1/20 0.38

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
SCHEMBL13565718 0.96 ALDH1A1 (0.55) KMT2AMEN1TDP1ALDH1A1KDM4E
SCHEMBL17411273 0.91 ALDH1A1 (0.51) KMT2AMEN1TDP1ALDH1A1KDM4E
SCHEMBL12634 0.91 KDM4E (0.53) KMT2AMEN1TDP1ALDH1A1KDM4E
SCHEMBL19198026 0.89 ALDH1A1 (0.49) KMT2AMEN1TDP1ALDH1A1KDM4E
SCHEMBL17411364 0.87 ALDH1A1 (0.47) KMT2AMEN1TDP1ALDH1A1KDM4E
SCHEMBL12369 0.83 MAPK1 (0.50) KMT2AALDH1A1KDM4ELMNAPOLB
SCHEMBL772876 0.83 MAPK1 (0.50) KMT2AALDH1A1KDM4ELMNAPOLB
SCHEMBL12449659 0.83 MAPK1 (0.50) KMT2AALDH1A1KDM4ELMNAPOLB
SCHEMBL22171142 0.80 ALDH1A1 (0.53) KMT2AMEN1TDP1ALDH1A1KDM4E
SCHEMBL15450944 0.79 KDM4E (0.62) KMT2AMEN1TDP1ALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3722298-B1 PYRROLO(PYRAZOLO)PYRIMIDINE DERIVATIVE AS LRRK2 INHIBITOR OSCOTEC INC (KR) 2023-08-02 EP disclosed
EP-3722298-A1 PYRROLO(PYRAZOLO)PYRIMIDINE DERIVATIVE AS LRRK2 INHIBITOR Oscotec Inc. (KR) 2020-10-14 EP disclosed
WO-2019112269-A1 PYRROLO(PYRAZOLO)PYRIMIDINE DERIVATIVE AS LRRK2 INHIBITOR 주식회사 오스코텍 2019-06-13 WO disclosed
EP-2389373-B1 DERIVATIVES OF N2-(3-PYRIDYL OR PHENYL)-N4-(4-PIPERIDYL)-2,4-PYRIMIDINEDIAMINE USEFUL IN THE TREATMENT OF INFLAMMATORY, AUTOIMMUNE OR PROLIFERATIVE DISEASES RIGEL PHARMACEUTICALS INC (US) 2017-05-17 EP disclosed
US-9149475-B2 Protein kinase C inhibitors and uses thereof RIGEL PHARMACEUTICALS, INC. (US) 2015-10-06 US disclosed
US-20130210810-A1 Protein Kinase C Inhibitors and Uses Thereof RIGEL PHARMACEUTICALS, INC. (US) 2013-08-15 US disclosed
US-7199147-B2 Rho kinase inhibitors DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2007-04-03 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 (1 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-20130210810-A1 Protein Kinase C Inhibitors and Uses Thereof PRKCH, PRKCA, PRKCB KMT2A 3505/4885MEN1 3946/4885TDP1 754/4885

“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.