SCHEMBL2805750

SCHEMBL2805750

COC(=O)c1ccc(Br)c(OCC(F)(F)C(F)F)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.50
KMT2A Q03164 4/20 0.50
NOTUM Q6P988 3/20 0.50
HTT P42858 3/20 0.50
KDM4E B2RXH2 2/20 0.50
MEN1 O00255 2/20 0.50
CYP2D6 P10635 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
SMN1; SMN2 Q16637 3/20 0.41
LMNA P02545 4/20 0.39
NPSR1 Q6W5P4 2/20 0.39
HPGD P15428 1/20 0.39
RAB9A P51151 1/20 0.39
PAX8 Q06710 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA7 P43166 1/20 0.38

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
SCHEMBL1934261 0.87 NOTUM (0.58) MAPTKMT2ANOTUMHTTKDM4E
SCHEMBL2801730 0.85 NPSR1 (0.50) MAPTKMT2AHTTKDM4EMEN1
SCHEMBL2801472 0.81 NOTUM (0.48) MAPTKMT2ANOTUMHTTKDM4E
SCHEMBL2801973 0.80 NOTUM (0.53) MAPTKMT2ANOTUMHTTKDM4E
SCHEMBL2802155 0.79 NOTUM (0.52) MAPTKMT2ANOTUMHTTKDM4E
SCHEMBL2802266 0.79 NOTUM (0.46) MAPTKMT2ANOTUMKDM4ECYP2C9
SCHEMBL980319 0.79 NOTUM (0.52) MAPTKMT2ANOTUMHTTKDM4E
SCHEMBL733132 0.78 TSHR (0.50) MAPTKMT2ANOTUMMEN1LMNA
SCHEMBL2803105 0.77 AR (0.53) MAPTKMT2ANOTUMHTTKDM4E
SCHEMBL12068781 0.77 NOTUM (0.49) MAPTKMT2ANOTUMKDM4EHPGD

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
WO-2010132016-A1 BIS-(SULFONYLAMINO) DERIVATIVES FOR TREATMENT OF PAIN AND INFLAMMATION ASTRAZENECA AB (SE) 2010-11-18 WO disclosed
WO-2010132016-A1 BIS-(SULFONYLAMINO) DERIVATIVES FOR TREATMENT OF PAIN AND INFLAMMATION ASTRAZENECA AB (SE) 2010-11-18 WO disclosed
US-20100292279-A1 Bis-(Sulfonylamino) Derivatives in Therapy ASTRAZENECA AB (SE) 2010-11-18 US disclosed
US-20100292279-A1 Bis-(Sulfonylamino) Derivatives in Therapy ASTRAZENECA AB (SE) 2010-11-18 US disclosed
US-20100292279-A1 Bis-(Sulfonylamino) Derivatives in Therapy ASTRAZENECA AB (SE) 2010-11-18 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-20100292279-A1 Bis-(Sulfonylamino) Derivatives in Therapy PTGER1, SULT2A1, SULT1E1 MAPT 1012/4885KMT2A 3450/4885NOTUM 954/4885

“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.