SCHEMBL5374401

SCHEMBL5374401

CCCCCCc1cc(S(=O)(=O)c2cc(CCCCCC)c(N)c(CCCCCC)c2)cc(CCCCCC)c1N

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 4/20 0.42
CA1 P00915 2/20 0.39
CA9 Q16790 2/20 0.39
GPR84 Q9NQS5 1/20 0.39
MEN1 O00255 3/20 0.39
HTT P42858 3/20 0.39
KMT2A Q03164 3/20 0.39
MAPT P10636 3/20 0.39
CYP3A4 P08684 2/20 0.39
TP53 P04637 1/20 0.39
ALOX5 P09917 1/20 0.39
TYR P14679 1/20 0.39
ALOX15 P16050 1/20 0.39
TSHR P16473 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
TLR8 Q9NR97 1/20 0.37
FUT7 Q11130 1/20 0.37
HTR2A P28223 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
LIPG Q9Y5X9 1/20 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
SCHEMBL5382807 0.98 CA2 (0.43) CA2CA1CA9GPR84MEN1
SCHEMBL3939833 0.93 CA2 (0.42) CA2CA1CA9HTTTYR
SCHEMBL3937543 0.85 CA2 (0.38) CA2CA1CA9HTTMAPT
SCHEMBL5380917 0.81 CA2 (0.46) CA2CA1CA9GPR84MEN1
SCHEMBL9750154 0.80 ALOX5 (0.47) CA2MEN1HTTKMT2AMAPT
SCHEMBL5373002 0.79 CA2 (0.47) CA2CA1CA9MEN1HTT
SCHEMBL3937091 0.78 POLB (0.52) CA2CA1CA9HTTMAPT
SCHEMBL11801651 0.77 CA2 (0.42) CA2CA1CA9HTTTYR
SCHEMBL11801662 0.77 GABRP (0.39) CA2CA1CA9HTTTYR
SCHEMBL14003767 0.77 PTGS2 (0.53) CA2CA1CA9GPR84CYP3A4

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
US-7202359-B2 Azaoxa heterocyclic compound and method of preparing the same CHANG CHUN PLASTICS CO., LTD. (TW) 2007-04-10 US disclosed
CN-1234706-C Nitrogen-oxygen heterocyclic compound and preparation method thereof CHANGCHUN ARTIFICIAL RESIN FAC (CN) 2006-01-04 CN disclosed
US-20050085634-A1 Azaoxa heterocyclic compound and method of preparing the same CHANG CHUN PLASTICS CO., LTD. (TW) 2005-04-21 US disclosed
CN-1490318-A Nitrogen-oxygen heterocyclic compound and preparation method thereof 长春人造树脂厂股份有限公司 2004-04-21 CN disclosed
US-20040068084-A1 Azaoxa heterocyclic compound and method of preparing the same CHANG CHUN PLASTICS CO., LTD. (TW) 2004-04-08 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-20040068084-A1 Azaoxa heterocyclic compound and method of preparing the same AOX1, KDM1A, BMI1 CA2 4496/4885CA1 2550/4885CA9 3200/4885
US-20050085634-A1 Azaoxa heterocyclic compound and method of preparing the same AOX1, KDM1A, BMI1 CA2 4419/4885CA1 2562/4885CA9 3087/4885

“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.