SCHEMBL5156837

SCHEMBL5156837

COc1cc(CCN2C(=O)CSC2c2cccc(OC(F)(F)F)c2)ccc1O

nearest known ligand 0.69

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.69
SMN1; SMN2 Q16637 1/20 0.59
MAPT P10636 2/20 0.56
KDM4E B2RXH2 1/20 0.56
MAPK1 P28482 1/20 0.56
TDP1 Q9NUW8 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
HCRTR1 O43613 5/20 0.52
HCRTR2 O43614 5/20 0.52
KCNA5 P22460 1/20 0.49
CACNA1B Q00975 1/20 0.44
PTGS1 P23219 1/20 0.43
PTGS2 P35354 1/20 0.43
ATM Q13315 1/20 0.43
CYP3A4 P08684 1/20 0.42
TP53 P04637 1/20 0.42
FYN P06241 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
SCHEMBL5151492 0.91 HCRTR1 (0.61) GAAHCRTR1HCRTR2CYP3A4
SCHEMBL5149413 0.88 SMN1; SMN2 (0.56) GAASMN1; SMN2MAPTKDM4EMAPK1
SCHEMBL5151299 0.87 GAA (0.71) GAASMN1; SMN2MAPTKDM4EMAPK1
SCHEMBL5153130 0.86 KCNA5 (0.50) GAASMN1; SMN2MAPTKDM4EMAPK1
SCHEMBL5152821 0.84 CACNA1B (0.53) GAASMN1; SMN2MAPTKDM4EMAPK1
SCHEMBL5152577 0.81 HCRTR1 (0.63) GAASMN1; SMN2MAPTKDM4EMAPK1
SCHEMBL5152818 0.81 GAA (0.73) GAASMN1; SMN2MAPTKDM4EMAPK1
SCHEMBL5152302 0.81 HCRTR1 (0.51) GAASMN1; SMN2MAPTKDM4EMAPK1
SCHEMBL5154974 0.81 HCRTR1 (0.50) GAASMN1; SMN2MAPTKDM4EMAPK1
SCHEMBL5156906 0.81 CACNA1B (0.48) GAASMN1; SMN2MAPTHCRTR1HCRTR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7223754-B2 Thiazolidinone, oxazolidinone, and imidazolone derivatives for treating lower urinary tract and related disorders DYNOGEN PHARMACEUTICALS, INC. (US) 2007-05-29 US disclosed
US-20070066597-A1 Thiazolidinone, oxazolidinone, and imidazolone derivatives for treating lower urinary tract and related disorders DYNOGEN PHARMACEUTICALS, INC. (US) 2007-03-22 US disclosed
US-20050148587-A1 Thiazolidinone, oxazolidinone, and imidazolone derivatives for treating lower urinary tract and related disorders DYNOGEN PHARMACEUTICALS, INC. (US) 2005-07-07 US disclosed
US-20050113421-A1 Thiazolidinone, oxazolidinone, and imidazolone derivatives for treating non-inflammatory gastrointestinal tract disorders DYNOGEN PHARMACEUTICALS, INC. (US) 2005-05-26 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 (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-20050113421-A1 Thiazolidinone, oxazolidinone, and imidazolone derivatives for treating non-inflammatory gastrointestinal tract disorders TRPV2, RYR2, VDAC2 GAA 3548/4885SMN1; SMN2 2615/4885MAPT 3411/4885
US-20070066597-A1 Thiazolidinone, oxazolidinone, and imidazolone derivatives for treating lower urinary tract and related disorders RYR2, CACNB2, CACNA1I GAA 3419/4885SMN1; SMN2 1195/4885MAPT 2432/4885
US-20050148587-A1 Thiazolidinone, oxazolidinone, and imidazolone derivatives for treating lower urinary tract and related disorders RYR2, CACNB2, CACNA1I GAA 3419/4885SMN1; SMN2 1195/4885MAPT 2432/4885

“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.