SCHEMBL5155080

SCHEMBL5155080

COc1cccc(CN2C(=O)CSC2c2cccc(C(F)(F)F)c2)c1OC

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CACNA1B Q00975 1/20 0.52
KDM4E B2RXH2 1/20 0.51
ALOX15 P16050 1/20 0.51
TSHR P16473 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
HCRTR1 O43613 1/20 0.49
HCRTR2 O43614 1/20 0.49
HTR7 P34969 4/20 0.45
SMN1; SMN2 Q16637 2/20 0.44
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
KCNA5 P22460 2/20 0.42
MAPT P10636 1/20 0.42
ALDH1A1 P00352 2/20 0.42
MAPK1 P28482 1/20 0.41
HTT P42858 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C19 P33261 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
SCHEMBL5152814 0.87 HCRTR1 (0.60) HCRTR1HCRTR2HTR7SMN1; SMN2MEN1
SCHEMBL5152193 0.86 KMT2A (0.51) KDM4ETDP1HCRTR1HCRTR2HTR7
SCHEMBL5149621 0.85 MEN1 (0.58) KDM4EHCRTR1HCRTR2HTR7SMN1; SMN2
SCHEMBL5153259 0.85 ACHE (0.53) TDP1HCRTR1HCRTR2HTR7SMN1; SMN2
SCHEMBL5156886 0.82 HCRTR1 (0.67) HCRTR1HCRTR2MEN1KMT2ACYP3A4
SCHEMBL5155016 0.82 KCNA5 (0.52) KDM4ETDP1HCRTR1HCRTR2HTR7
SCHEMBL5154879 0.81 KMT2A (0.65) KDM4ETDP1HCRTR1HCRTR2HTR7
SCHEMBL5151355 0.81 MAPT (0.56) KDM4ETDP1HCRTR1HCRTR2HTR7
SCHEMBL5151609 0.79 HCRTR1 (0.57) KDM4EHCRTR1HCRTR2MEN1KMT2A
SCHEMBL5156230 0.78 MEN1 (0.54) KDM4ETDP1HCRTR1HCRTR2HTR7

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 CACNA1B 13/4885KDM4E 4149/4885ALOX15 1457/4885
US-20070066597-A1 Thiazolidinone, oxazolidinone, and imidazolone derivatives for treating lower urinary tract and related disorders RYR2, CACNB2, CACNA1I CACNA1B 10/4885KDM4E 3784/4885ALOX15 3215/4885
US-20050148587-A1 Thiazolidinone, oxazolidinone, and imidazolone derivatives for treating lower urinary tract and related disorders RYR2, CACNB2, CACNA1I CACNA1B 10/4885KDM4E 3784/4885ALOX15 3215/4885

“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.