SCHEMBL7953769

SCHEMBL7953769

CNS(=O)(=O)c1ccccc1Oc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CASP1 P29466 10/20 0.55
LMNA P02545 1/20 0.47
HTT P42858 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
CYP1A2 P05177 1/20 0.45
PTGS2 P35354 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
PGR P06401 2/20 0.43
POLB P06746 1/20 0.42
MAPT P10636 1/20 0.42
RIPK1 Q13546 1/20 0.42
TSHR P16473 1/20 0.42

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
SCHEMBL20998613 0.82 CASP1 (0.58) CASP1
SCHEMBL2371550 0.79 L3MBTL1 (0.61) SMN1; SMN2CYP1A2L3MBTL1TSHR
SCHEMBL29965203 0.79 L3MBTL1 (0.61) SMN1; SMN2CYP1A2L3MBTL1TSHR
SCHEMBL6565184 0.79 CYP1A2 (0.43) CASP1CYP1A2L3MBTL1MAPT
SCHEMBL502864 0.79 CASP1 (0.50) CASP1LMNAHTTSMN1; SMN2PTGS2
SCHEMBL146565 0.79 CASP1 (0.50) CASP1LMNAHTTSMN1; SMN2PTGS2
SCHEMBL1745319 0.78 CASP1 (0.51) CASP1PTGS2L3MBTL1PGRPOLB
Ammonia Solution, Strong SCHEMBL502557 0.77 CASP1 (0.49) CASP1LMNAHTTSMN1; SMN2PTGS2
SCHEMBL11599660 0.77 CASP1 (0.49) CASP1LMNAHTTSMN1; SMN2PTGS2
SCHEMBL10849395 0.77 CASP1 (0.57) CASP1SMN1; SMN2

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
WO-2018109642-A1 N-ARYL PYRAZOLES AS NRF2 REGULATORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2018-06-21 WO disclosed
US-8541588-B2 Sulfonamide derivatives PFIZER LIMITED (GB) 2013-09-24 US disclosed
US-20120165309-A1 HETERO RING DERIVATIVE ASTELLAS PHARMA INC. (JP) 2012-06-28 US disclosed
EP-2397479-A1 HETERO RING DERIVATIVE Astellas Pharma Inc. (JP) 2011-12-21 EP disclosed
WO-2010092962-A1 HETERO RING DERIVATIVE アステラス製薬株式会社 (JP) 2010-08-19 WO disclosed
US-20010016659-A1 Omega-carboxyaryl substituted diphenyl ureas as raf kinase inhibitors BAYER HEALTHCARE LLC 2001-08-23 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 (2 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-20120165309-A1 HETERO RING DERIVATIVE IL2, PIK3R2, IL2RA CASP1 1319/4885LMNA 4381/4885HTT 4317/4885
US-20010016659-A1 Omega-carboxyaryl substituted diphenyl ureas as raf kinase inhibitors BRAF, RAF1, ARAF CASP1 3215/4885LMNA 3199/4885HTT 3005/4885

“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.