SCHEMBL5381291

SCHEMBL5381291

CCc1cc(SOSc2ccc(N)c(CC)c2)ccc1N

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.59
MAPT P10636 3/20 0.59
POLB P06746 3/20 0.59
HTT P42858 2/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
NPC1 O15118 1/20 0.33
APOBEC3G Q9HC16 1/20 0.33
KDM4E B2RXH2 1/20 0.32
HPGD P15428 1/20 0.32
MAPK1 P28482 1/20 0.32
HSD17B10 Q99714 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
S100B P04271 1/20 0.32

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
SCHEMBL434003 0.85 ALDH1A1 (0.44) ALDH1A1MAPTPOLBMEN1KMT2A
SCHEMBL5377909 0.82 MAPT (0.41) ALDH1A1MAPTPOLBHTTMEN1
SCHEMBL11803703 0.82 ALDH1A1 (0.65) ALDH1A1MAPTPOLBHTTMEN1
SCHEMBL3848692 0.82 MAPT (0.65) ALDH1A1MAPTPOLBHTTMEN1
SCHEMBL5379533 0.81 MAPT (0.41) ALDH1A1MAPTPOLBHTTMEN1
SCHEMBL10570644 0.80 ALDH1A1 (0.62) ALDH1A1MAPTPOLBHTTMEN1
SCHEMBL5381223 0.80 ALOX5 (0.41) ALDH1A1MAPTPOLBHTTMEN1
SCHEMBL9700714 0.78 MAPT (0.61) ALDH1A1MAPTPOLBHTTMEN1
SCHEMBL5397993 0.78 HTT (0.44) ALDH1A1MAPTPOLBHTT
SCHEMBL27885463 0.77 ESR1 (0.47) ALDH1A1MAPTPOLBHTTMEN1

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
CN-105555479-A Nonwoven abrasive article with wax antiloading compound and method of using the same 3M INNOVATIVE PROPERTIES CO 2016-05-04 CN disclosed
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 ALDH1A1 81/4885MAPT 2811/4885POLB 1238/4885
US-20050085634-A1 Azaoxa heterocyclic compound and method of preparing the same AOX1, KDM1A, BMI1 ALDH1A1 116/4885MAPT 2734/4885POLB 1310/4885

“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.