SCHEMBL6736752

SCHEMBL6736752

CSc1c(F)cc(C/C(=N/O)c2ccccc2)cc1F

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 5/20 0.40
KDM4E B2RXH2 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ATM Q13315 1/20 0.35
CTSL P07711 1/20 0.34
TSHR P16473 1/20 0.33
ALOX12 P18054 1/20 0.33
XDH P47989 5/20 0.33
NLRP3 Q96P20 2/20 0.33
TLR4 O00206 1/20 0.33
HTT P42858 1/20 0.33
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL6736753 1.00 MGLL (0.40) MGLLKDM4ESMN1; SMN2ATMCTSL
SCHEMBL6736924 0.88 MGLL (0.46) MGLLKDM4ESMN1; SMN2CTSLTSHR
SCHEMBL6732090 0.79 MAPT (0.42) KDM4ESMN1; SMN2HTTMEN1KMT2A
SCHEMBL6169609 0.75 KDM4E (0.50) KDM4ESMN1; SMN2ATMCTSLTSHR
SCHEMBL6169610 0.75 KDM4E (0.50) KDM4ESMN1; SMN2ATMCTSLTSHR
SCHEMBL257218 0.73 CTSL (0.55) MGLLKDM4ESMN1; SMN2ATMCTSL
SCHEMBL4586157 0.73 CTSL (0.55) MGLLKDM4ESMN1; SMN2ATMCTSL
SCHEMBL4586154 0.73 CTSL (0.55) MGLLKDM4ESMN1; SMN2ATMCTSL
SCHEMBL28291535 0.73 CTBP2 (0.51) MGLLKDM4ESMN1; SMN2CTSLXDH
SCHEMBL4807381 0.72 KDM4E (0.50) MGLLKDM4ESMN1; SMN2CTSLTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040138261-A1 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation PHARMACIA CORPORATION 2004-07-15 US disclosed
US-6699884-B2 ANTIINFLAMMATORY CYCLOOXYGENASE INHIBITORS. PHARMACIA CORPORATION 2004-03-02 US disclosed
US-6673818-B2 TREATING CYCLOOXYGENASE-2 MEDIATED DISORDERS, SUCH AS ARTHRITIS, PAIN, FEVER AND CANCER PHARMACIA CORPORATION 2004-01-06 US disclosed
US-20030149078-A1 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation PHARMACIA CORPORATION 2003-08-07 US disclosed
US-20030032657-A1 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation PHARMACIA CORPORATION 2003-02-13 US disclosed
EP-1251126-A2 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation Pharmacia Corporation (US) 2002-10-23 EP 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 (3 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-20040138261-A1 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation FPR1, FPR2, FPR3 MGLL 2803/4885KDM4E 3382/4885SMN1; SMN2 1515/4885
US-20030149078-A1 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation FPR1, FPR2, FPR3 MGLL 2803/4885KDM4E 3382/4885SMN1; SMN2 1515/4885
US-20030032657-A1 Fluoro-substituted benzenesulfonyl compounds for the treatment of inflammation FPR1, FPR2, FPR3 MGLL 2803/4885KDM4E 3382/4885SMN1; SMN2 1515/4885

“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.