SCHEMBL5566604

SCHEMBL5566604

FC(F)C(F)(F)C(F)(F)C(F)(F)F.O=S(=O)(Cl)Cl

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.37
TSHR P16473 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
CA2 P00918 2/20 0.31
CA1 P00915 1/20 0.30
MMP1 P03956 1/20 0.30
MMP2 P08253 1/20 0.30
MMP9 P14780 1/20 0.30
MMP8 P22894 1/20 0.30
MMP13 P45452 1/20 0.30

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
SCHEMBL9681471 0.90 CA2 (0.38) KDM4ETSHRTDP1CA2CA1
SCHEMBL202580 0.86 KDM4E (0.38) KDM4ETSHRTDP1CA2CA1
SCHEMBL27945649 0.83 KDM4E (0.30) KDM4ETSHRTDP1
SCHEMBL6536446 0.83 KDM4E (0.40) KDM4ETSHRTDP1
SCHEMBL37506 0.83 KDM4E (0.40) KDM4ETSHRTDP1
Sulfuric Acid SCHEMBL21876328 0.82 KDM4E (0.40) KDM4ETSHRTDP1CA2CA1
Sulfuric Acid SCHEMBL22118762 0.82 KDM4E (0.40) KDM4ETSHRTDP1CA2CA1
SCHEMBL28442614 0.80 KDM4E (0.34) KDM4ETSHRTDP1
Trifluoromethanesulfonic Acid SCHEMBL9146130 0.80 KDM4E (0.39) KDM4ETSHRTDP1CA2CA1
Iodide SCHEMBL11068952 0.80 KDM4E (0.39) KDM4ETSHRTDP1

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
CN-106458903-B Method for producing heteroaromatic sulfonamide compound 宇部兴产株式会社 2021-02-05 CN disclosed
US-20070113356-A1 Reactive polysaccharide derivatives, their preparation and their use CIBA SPECIALTY CHEMICALS CORP. (US) 2007-05-24 US disclosed
EP-1694713-A1 REACTIVE POLYSACCHARIDE DERIVATES, THEIR PREPARATION AND THEIR USE Ciba Specialty Chemicals Holding Inc. (CH) 2006-08-30 EP disclosed
WO-2005058975-A1 REACTIVE POLYSACCHARIDE DERIVATES, THEIR PREPARATION AND THEIR USE CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2005-06-30 WO disclosed
US-5099025-A PREPARATION OF 2-CHLORO-5-METHYL-PYRIDINE BAYER AKTIENGESELLSCHAFT (DE) 1992-03-24 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-20070113356-A1 Reactive polysaccharide derivatives, their preparation and their use C1S, H1-0, H1-4 KDM4E 3249/4885TSHR 4618/4885TDP1 2387/4885

“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.