SCHEMBL24757352

SCHEMBL24757352

Cc1nn(CC2CCCOC2)c(C(=O)Nc2cccc(S(C)(=O)=O)c2)c1C(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 2/20 0.41
AKR1C3 P42330 1/20 0.41
AKR1C2 P52895 1/20 0.41
ELANE P08246 2/20 0.39
CARM1 Q86X55 1/20 0.38
KLKB1 P03952 1/20 0.38
IRAK4 Q9NWZ3 3/20 0.38
CREBBP Q92793 2/20 0.38
BRD4 O60885 1/20 0.38
DHODH Q02127 1/20 0.37
GRM4 Q14833 1/20 0.37
KDM4E B2RXH2 1/20 0.37
MAPK1 P28482 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
TRPV4 Q9HBA0 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
SLC2A1 P11166 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
SCHEMBL24759018 0.95 ELANE (0.42) AKR1C3AKR1C2ELANECARM1KLKB1
SCHEMBL24758175 0.92 AKR1C3 (0.42) AKR1C3AKR1C2CARM1KLKB1IRAK4
SCHEMBL24906418 0.90 AKR1C3 (0.46) AKR1C3AKR1C2CARM1KLKB1IRAK4
SCHEMBL24906513 0.87 MAPT (0.42) CARM1KDM4EMAPK1MEN1KMT2A
SCHEMBL24758427 0.86 CARM1 (0.41) AKR1C3AKR1C2CARM1KLKB1IRAK4
SCHEMBL24906417 0.85 MAPT (0.40) AKR1C3AKR1C2CARM1KLKB1DHODH
SCHEMBL30107048 0.85 NR1H2 (0.41) NR1H2AKR1C3AKR1C2ELANECARM1
SCHEMBL24757358 0.85 NR1H2 (0.41) NR1H2AKR1C3AKR1C2ELANECARM1
SCHEMBL24906499 0.85 AKR1C3 (0.44) AKR1C3AKR1C2CARM1KLKB1IRAK4
SCHEMBL24758200 0.84 GRM4 (0.40) AKR1C3AKR1C2GRM4SLC2A1SLC2A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4355733-A1 SUBSTITUTED PYRAZOLE AMIDES Grünenthal GmbH (DE) 2024-04-24 EP claimed
WO-2022263498-A1 SUBSTITUTED PYRAZOLE AMIDES Grünenthal GmbH (DE) 2022-12-22 WO claimed
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
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 NR1H2 1438/4885AKR1C3 1950/4885AKR1C2 1995/4885
US-20230025025-A1 SUBSTITUTED PYRAZOLE AMIDES SCN8A, SCN1A, SCN7A NR1H2 1438/4885AKR1C3 1950/4885AKR1C2 1995/4885

“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.