SCHEMBL7045992

SCHEMBL7045992

O=S(=O)(Oc1ccc(-c2ccccc2)cc1)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 11/20 0.51
CA1 P00915 10/20 0.51
CA9 Q16790 2/20 0.51
PIK3CD O00329 1/20 0.49
PIK3CA P42336 1/20 0.49
PIK3CB P42338 1/20 0.49
KIF11 P52732 2/20 0.42
JAK2 O60674 1/20 0.42
JAK3 P52333 1/20 0.42
PTK2 Q05397 1/20 0.42
CA12 O43570 2/20 0.40
MEN1 O00255 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
KMT2A Q03164 1/20 0.38
SENP8 Q96LD8 1/20 0.38
SENP7 Q9BQF6 1/20 0.38
SENP6 Q9GZR1 1/20 0.38
PTPN1 P18031 1/20 0.37
HDAC1 Q13547 3/20 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
SCHEMBL6474468 0.98 CA2 (0.50) CA2CA1CA9PIK3CDPIK3CA
SCHEMBL25453605 0.91 CA2 (0.44) CA2CA1CA9PIK3CDPIK3CA
SCHEMBL6479936 0.90 CA2 (0.45) CA2CA1CA9PIK3CDPIK3CA
Biphenyl SCHEMBL3395019 0.90 PIK3CD (0.45) CA2CA1CA9PIK3CDPIK3CA
SCHEMBL15683037 0.88 PIK3CD (0.44) CA2CA1CA9PIK3CDPIK3CA
SCHEMBL27366575 0.88 PIK3CD (0.44) CA2CA1CA9PIK3CDPIK3CA
SCHEMBL6900759 0.88 CA2 (0.46) CA2CA1CA9PIK3CDPIK3CA
Iodide SCHEMBL5315919 0.88 PIK3CD (0.44) CA2CA1CA9PIK3CDPIK3CA
SCHEMBL575913 0.88 CA2 (0.51) CA2CA1CA9PIK3CDPIK3CA
SCHEMBL20622597 0.86 CA2 (0.45) CA2CA1CA9PIK3CDPIK3CA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4076423-A1 TRPML MODULATORS Casma Therapeutics, Inc. (US) 2022-10-26 EP disclosed
US-20030220386-A1 Delta 1-pyrrolines for use as pesticides BAYER CROPSCIENCE AG (DE) 2003-11-27 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-20030220386-A1 Delta 1-pyrrolines for use as pesticides DDT, OPRD1, PRMT1 CA2 2815/4885CA1 2269/4885CA9 4337/4885

“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.