SCHEMBL5152128

SCHEMBL5152128

O=C1CSC(c2cccc(OC(F)(F)F)c2)N1CCc1ccc2c(c1)OCO2

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.48
MGAM O43451 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
CACNA1B Q00975 1/20 0.46
HTT P42858 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
CHRM5 P08912 1/20 0.44
GAA P10253 3/20 0.44
KCNA5 P22460 1/20 0.44
KDM4E B2RXH2 1/20 0.44
MAPT P10636 1/20 0.44
MAPK1 P28482 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
HCRTR1 O43613 1/20 0.43
HCRTR2 O43614 1/20 0.43
MCHR1 Q99705 1/20 0.42
HSD17B10 Q99714 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
SCHEMBL5156183 0.91 MGAM (0.57) ALDH1A1MGAMSMN1; SMN2HTTNPSR1
SCHEMBL5152821 0.85 CACNA1B (0.53) ALDH1A1SMN1; SMN2CACNA1BHTTNPSR1
SCHEMBL5149413 0.84 SMN1; SMN2 (0.56) SMN1; SMN2CACNA1BCHRM5GAAKCNA5
SCHEMBL5153130 0.84 KCNA5 (0.50) ALDH1A1SMN1; SMN2CACNA1BHTTNPSR1
SCHEMBL5151414 0.82 ACHE (0.56) ALDH1A1MGAMSMN1; SMN2CACNA1BGAA
SCHEMBL5151364 0.81 MAPT (0.55) ALDH1A1SMN1; SMN2CACNA1BNPSR1GAA
Hydrochloric Acid SCHEMBL5156372 0.80 MAPT (0.54) ALDH1A1SMN1; SMN2CACNA1BNPSR1GAA
SCHEMBL5156837 0.80 GAA (0.69) SMN1; SMN2CACNA1BGAAKCNA5KDM4E
SCHEMBL5154974 0.80 HCRTR1 (0.50) SMN1; SMN2CACNA1BNPSR1GAAKCNA5
SCHEMBL5156906 0.80 CACNA1B (0.48) SMN1; SMN2CACNA1BNPSR1GAAKCNA5

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 ALDH1A1 3381/4885MGAM 2524/4885SMN1; SMN2 2615/4885
US-20070066597-A1 Thiazolidinone, oxazolidinone, and imidazolone derivatives for treating lower urinary tract and related disorders RYR2, CACNB2, CACNA1I ALDH1A1 1370/4885MGAM 3677/4885SMN1; SMN2 1195/4885
US-20050148587-A1 Thiazolidinone, oxazolidinone, and imidazolone derivatives for treating lower urinary tract and related disorders RYR2, CACNB2, CACNA1I ALDH1A1 1370/4885MGAM 3677/4885SMN1; SMN2 1195/4885

“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.