SCHEMBL6448837

SCHEMBL6448837

NC(=O)CN1C(=O)CSC1c1cccc(OC(F)(F)F)c1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 2/20 0.46
HCRTR2 O43614 2/20 0.46
CACNA1B Q00975 1/20 0.42
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
ACHE P22303 2/20 0.41
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
POLB P06746 1/20 0.39
PTGS1 P23219 1/20 0.39
PTGS2 P35354 1/20 0.39
CETP P11597 1/20 0.38
MGLL Q99685 1/20 0.38
KCNN4 O15554 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL5152352 0.90 HCRTR1 (0.47) HCRTR1HCRTR2CACNA1BCYP2C9CYP2C19
SCHEMBL6140644 0.89 HCRTR1 (0.46) HCRTR1HCRTR2CACNA1BACHEKMT2A
SCHEMBL5150118 0.86 HCRTR1 (0.46) HCRTR1HCRTR2CACNA1BACHEKMT2A
SCHEMBL5149596 0.86 CACNA1B (0.46) HCRTR1HCRTR2CACNA1BCYP2C9CYP2C19
SCHEMBL5156906 0.84 CACNA1B (0.48) HCRTR1HCRTR2CACNA1BACHEKMT2A
SCHEMBL5155519 0.84 HCRTR1 (0.49) HCRTR1HCRTR2CACNA1BACHEKMT2A
SCHEMBL6827571 0.84 HCRTR1 (0.49) HCRTR1HCRTR2CACNA1BACHEKMT2A
SCHEMBL5151627 0.84 EGLN1 (0.43) HCRTR1HCRTR2CACNA1BACHEKMT2A
SCHEMBL5152211 0.83 ACHE (0.50) HCRTR1HCRTR2CACNA1BACHEPOLB
SCHEMBL5154974 0.82 HCRTR1 (0.50) HCRTR1HCRTR2CACNA1BACHEPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 (1 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 194/4885CACNA1B 13/4885

“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.