SCHEMBL5152808

SCHEMBL5152808

O=C1CSC(c2ccc(C(F)(F)F)c(F)c2)N1CCc1cccnc1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.53
ALDH1A1 P00352 1/20 0.53
CACNA1B Q00975 2/20 0.48
POLB P06746 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
TDP1 Q9NUW8 2/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
KCNA5 P22460 1/20 0.44
GAA P10253 2/20 0.42
LMNA P02545 1/20 0.42
HPGD P15428 1/20 0.42
KDM4E B2RXH2 1/20 0.42
MAPK1 P28482 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
HTR7 P34969 1/20 0.42
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C19 P33261 1/20 0.41
GFER P55789 1/20 0.41

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
SCHEMBL5152195 0.85 MAPT (0.56) MAPTALDH1A1CACNA1BPOLBNPSR1
SCHEMBL5156174 0.84 CACNA1B (0.67) MAPTALDH1A1CACNA1BPOLBNPSR1
SCHEMBL5155056 0.80 MAPT (0.61) MAPTALDH1A1POLBNPSR1TDP1
SCHEMBL5156963 0.80 ALDH1A1 (0.52) MAPTALDH1A1CACNA1BTDP1SMN1; SMN2
SCHEMBL5151364 0.80 MAPT (0.55) MAPTALDH1A1CACNA1BPOLBNPSR1
Hydrochloric Acid SCHEMBL5156372 0.79 MAPT (0.54) MAPTALDH1A1CACNA1BPOLBNPSR1
SCHEMBL5152818 0.77 GAA (0.73) MAPTCACNA1BTDP1SMN1; SMN2KCNA5
SCHEMBL5152878 0.76 PTGS1 (0.43) MAPTALDH1A1CACNA1BPOLBNPSR1
SCHEMBL5152753 0.76 PTGS1 (0.43) CACNA1BSMN1; SMN2KCNA5
SCHEMBL5155012 0.76 ACHE (0.47)

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 MAPT 3411/4885ALDH1A1 3381/4885CACNA1B 13/4885
US-20070066597-A1 Thiazolidinone, oxazolidinone, and imidazolone derivatives for treating lower urinary tract and related disorders RYR2, CACNB2, CACNA1I MAPT 2432/4885ALDH1A1 1370/4885CACNA1B 10/4885
US-20050148587-A1 Thiazolidinone, oxazolidinone, and imidazolone derivatives for treating lower urinary tract and related disorders RYR2, CACNB2, CACNA1I MAPT 2432/4885ALDH1A1 1370/4885CACNA1B 10/4885

“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.