SCHEMBL5156901

SCHEMBL5156901

O=C1CSC(c2cccc(OC(F)(F)F)c2)N1Cc1ccccc1F

nearest known ligand 0.49

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 3/20 0.49
HCRTR2 O43614 3/20 0.49
KMT2A Q03164 5/20 0.44
POLB P06746 1/20 0.44
ALDH1A1 P00352 2/20 0.43
CACNA1B Q00975 1/20 0.43
MEN1 O00255 4/20 0.43
MAPT P10636 3/20 0.42
ACHE P22303 1/20 0.41
GFER P55789 1/20 0.40

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
SCHEMBL5154787 0.93 HCRTR1 (0.48) HCRTR1HCRTR2KMT2APOLBALDH1A1
SCHEMBL5151593 0.90 HCRTR1 (0.50) HCRTR1HCRTR2KMT2APOLBALDH1A1
SCHEMBL5152293 0.90 HCRTR1 (0.52) HCRTR1HCRTR2KMT2APOLBALDH1A1
SCHEMBL5155483 0.86 HCRTR1 (0.48) HCRTR1HCRTR2KMT2APOLBALDH1A1
SCHEMBL5156907 0.86 KMT2A (0.60) HCRTR1HCRTR2KMT2APOLBALDH1A1
SCHEMBL5155010 0.85 HCRTR1 (0.54) HCRTR1HCRTR2KMT2APOLBALDH1A1
SCHEMBL5155075 0.85 HCRTR1 (0.54) HCRTR1HCRTR2KMT2APOLBALDH1A1
SCHEMBL5151441 0.85 HCRTR1 (0.61) HCRTR1HCRTR2KMT2APOLBALDH1A1
SCHEMBL5149539 0.84 HCRTR1 (0.55) HCRTR1HCRTR2KMT2APOLBALDH1A1
SCHEMBL5151542 0.83 HCRTR1 (0.54) HCRTR1HCRTR2KMT2APOLBALDH1A1

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 5 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
WO-2004017965-A1 1,3-THIAZOLIN-4-ONES AS THERAPEUTIC COMPOUNDS IN THE TREATMENT OF PAIN IONIX PHARMACEUTICALS LIMITED (GB) 2004-03-04 WO 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 HCRTR1 1608/4885HCRTR2 194/4885KMT2A 4084/4885
US-20070066597-A1 Thiazolidinone, oxazolidinone, and imidazolone derivatives for treating lower urinary tract and related disorders RYR2, CACNB2, CACNA1I HCRTR1 2195/4885HCRTR2 251/4885KMT2A 3401/4885
US-20050148587-A1 Thiazolidinone, oxazolidinone, and imidazolone derivatives for treating lower urinary tract and related disorders RYR2, CACNB2, CACNA1I HCRTR1 2195/4885HCRTR2 251/4885KMT2A 3401/4885

“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.