SCHEMBL4836672

SCHEMBL4836672

CC(C)(C)OC(=O)NCc1csc(C(=O)O)c1Cl

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.37
KDM4A O75164 1/20 0.37
KCNA5 P22460 1/20 0.37
CA12 O43570 1/20 0.36
CA1 P00915 1/20 0.36
CA7 P43166 1/20 0.36
CA14 Q9ULX7 1/20 0.36
HDAC10 Q969S8 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
CTSL P07711 1/20 0.36
CTSS P25774 1/20 0.36
CTSK P43235 1/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
KDM4E B2RXH2 1/20 0.35
LMNA P02545 1/20 0.35
IDO1 P14902 2/20 0.35
HDAC1 Q13547 1/20 0.35
POLB P06746 1/20 0.35
MAPK1 P28482 1/20 0.35

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
SCHEMBL5257251 0.78 KDM4A (0.41) GAAKDM4AKCNA5CA12CA1
SCHEMBL6593177 0.75 NQO2 (0.42) GAAMEN1KMT2AKDM4ELMNA
SCHEMBL3309158 0.75 HTR2C (0.36)
SCHEMBL1671690 0.73 IDO1 (0.42) GAAKDM4AKCNA5HDAC10HDAC6
SCHEMBL5480838 0.72 MAPT (0.58) CTSLCTSSCTSKIDO1MAPK1
SCHEMBL25170234 0.70 KMT2A (0.43) GAACA12CA1MEN1KMT2A
SCHEMBL17086062 0.70 KDM4A (0.42) GAAKDM4ACA12CA1CA7
SCHEMBL6097900 0.70 POLB (0.47) GAAKDM4AKCNA5CA12CA1
SCHEMBL1346036 0.70 EPHX2 (0.64) KDM4AHDAC10HDAC6LMNAIDO1
SCHEMBL7468804 0.70 CTSS (0.40) KDM4AKCNA5CTSLCTSSCTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080255109-A1 Non-peptide GnRH antagonists VANTIA, LTD 2008-10-16 US disclosed
US-7365065-B2 Non-peptide GnRH antagonists FERRING B.V. (NL) 2008-04-29 US disclosed
US-20050222139-A1 Non-peptide gnrh antagonists FERRING B.V. (NL) 2005-10-06 US disclosed
CN-1642917-A Non-peptide GnRH antagonists FERRING BV (NL) 2005-07-20 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-20050222139-A1 Non-peptide gnrh antagonists GNRHR, BRS3, FSHR GAA 4875/4885KDM4A 1668/4885KCNA5 2197/4885
US-20080255109-A1 Non-peptide GnRH antagonists GNRHR, BRS3, FSHR GAA 4878/4885KDM4A 1503/4885KCNA5 2320/4885

“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.