SCHEMBL25319233

SCHEMBL25319233

O=S(=O)(Oc1ccc(-c2ccc(C(F)(F)F)nc2)cc1)C(F)(F)F

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 3/20 0.46
PIK3CA P42336 2/20 0.46
PI4KB Q9UBF8 2/20 0.46
MAP4K4 O95819 1/20 0.46
MINK1 Q8N4C8 1/20 0.46
KIF11 P52732 2/20 0.44
TRPV4 Q9HBA0 1/20 0.41
GRM5 P41594 1/20 0.40
PIK3CD O00329 1/20 0.39
PIK3CB P42338 1/20 0.39
PI4KA P42356 1/20 0.39
PIK3CG P48736 1/20 0.39
MRGPRX4 Q96LA9 1/20 0.39
CA1 P00915 2/20 0.38
CA2 P00918 2/20 0.38
CA9 Q16790 2/20 0.38
LGMN Q99538 1/20 0.36
PTPRZ1 P23471 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
SCHEMBL30536004 1.00 KCNH2 (0.46) KCNH2PIK3CAPI4KBMAP4K4MINK1
SCHEMBL1713465 0.81 KIF11 (0.55) KIF11CA1CA2CA9
SCHEMBL25318934 0.79 ADAMTS4 (0.43) KIF11CA1CA2
SCHEMBL2403135 0.77 KCNH2 (0.41) KCNH2PIK3CAPI4KBMAP4K4MINK1
SCHEMBL28487624 0.77 NPC1 (0.55) KIF11CA1CA2CA9
SCHEMBL9155754 0.77 KDM4E (0.49) KCNH2PIK3CAPI4KBMAP4K4MINK1
SCHEMBL31414063 0.77 KDM4E (0.49) KCNH2PIK3CAPI4KBMAP4K4MINK1
SCHEMBL26549580 0.76 KIF11 (0.71) KIF11CA1CA2CA9
SCHEMBL24360466 0.76 CA2 (0.62) KIF11CA1CA2CA9
SCHEMBL5532552 0.76 CA2 (0.62) KIF11CA1CA2CA9

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-20250122173-A1 MODULATORS OF RHO-ASSOCIATED PROTEIN KINASE REDX PHARMA LTD (GB) 2025-04-17 US disclosed
EP-4466071-A1 MODULATORS OF RHO-ASSOCIATED PROTEIN KINASE (ROCK) Redx Pharma Limited (GB) 2024-11-27 EP disclosed
WO-2023139379-A1 MODULATORS OF RHO-ASSOCIATED PROTEIN KINASE (ROCK) REDX PHARMA PLC (GB) 2023-07-27 WO disclosed
WO-2023139379-A1 MODULATORS OF RHO-ASSOCIATED PROTEIN KINASE (ROCK) REDX PHARMA PLC (GB) 2023-07-27 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 (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-20250122173-A1 MODULATORS OF RHO-ASSOCIATED PROTEIN KINASE ROCK1, ROCK2, RHOA KCNH2 4438/4885PIK3CA 685/4885PI4KB 568/4885

“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.