SCHEMBL24906337

SCHEMBL24906337

CCOC(=O)c1n[nH]c(C(F)(F)F)c1C

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.47
POLB P06746 2/20 0.46
PDE4D Q08499 1/20 0.44
KMT2A Q03164 4/20 0.43
MAPT P10636 4/20 0.43
HDAC4 P56524 2/20 0.39
HDAC6 Q9UBN7 2/20 0.39
HDAC3 O15379 1/20 0.39
HDAC1 Q13547 1/20 0.39
MEN1 O00255 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
ALOX15 P16050 1/20 0.38
HCAR2 Q8TDS4 1/20 0.37
ALDH1A1 P00352 1/20 0.36

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
SCHEMBL3463424 0.84 KDM4E (0.44) KDM4EPOLBPDE4DKMT2AMAPT
SCHEMBL27242303 0.81 PDE4D (0.51) KDM4EPOLBPDE4DKMT2AMAPT
SCHEMBL9912567 0.80 ABCC8 (0.43) KDM4EPOLBPDE4DKMT2AMAPT
SCHEMBL15564064 0.79 KDM4E (0.46) KDM4EPOLBPDE4DKMT2AMAPT
SCHEMBL570053 0.78 HCAR2 (0.50) KMT2AHCAR2
SCHEMBL19158730 0.78 PDE4D (0.59) KDM4EPOLBPDE4DKMT2AMAPT
SCHEMBL7470961 0.77 PDE4D (0.65) KDM4EPOLBPDE4DKMT2AMAPT
SCHEMBL1929279 0.77 POLB (0.42) KDM4EPOLBPDE4DKMT2AMAPT
SCHEMBL15555140 0.76 KDM4E (0.51) KDM4EPOLBPDE4DKMT2AMAPT
SCHEMBL10860621 0.76 KDM4E (0.51) KDM4EPOLBPDE4DKMT2AMAPT

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-11999699-B2 Substituted pyrazole amides Grünenthal GmbH (DE) 2024-06-04 US disclosed
EP-4355733-A1 SUBSTITUTED PYRAZOLE AMIDES Grünenthal GmbH (DE) 2024-04-24 EP disclosed
US-20230025025-A1 SUBSTITUTED PYRAZOLE AMIDES GRUENENTHAL GMBH (DE) 2023-01-26 US disclosed
US-20230025025-A1 SUBSTITUTED PYRAZOLE AMIDES GRUENENTHAL GMBH (DE) 2023-01-26 US disclosed
WO-2022263498-A1 SUBSTITUTED PYRAZOLE AMIDES Grünenthal GmbH (DE) 2022-12-22 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 (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-11999699-B2 Substituted pyrazole amides SCN8A, SCN1A, SCN7A KDM4E 2803/4885POLB 4395/4885PDE4D 484/4885
US-20230025025-A1 SUBSTITUTED PYRAZOLE AMIDES SCN8A, SCN1A, SCN7A KDM4E 2803/4885POLB 4395/4885PDE4D 484/4885

“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.