SCHEMBL5017463

SCHEMBL5017463

COC(=O)Cc1csc(-c2ccc(C(F)(F)F)cc2)n1

nearest known ligand 0.61

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 7/20 0.61
HTT P42858 1/20 0.61
TP53 P04637 12/20 0.61
MAPT P10636 4/20 0.57
POLB P06746 1/20 0.55
KDM4E B2RXH2 2/20 0.55
SMN1; SMN2 Q16637 1/20 0.55
ALDH1A1 P00352 1/20 0.54
HPGD P15428 1/20 0.54

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
SCHEMBL4905943 0.88 POLB (0.62) LMNAHTTTP53MAPTPOLB
SCHEMBL628077 0.87 RHOC (0.50) LMNAHTTTP53MAPTPOLB
SCHEMBL5025486 0.84 LMNA (0.72) LMNAHTTTP53MAPTPOLB
SCHEMBL27344271 0.83 ALDH1A1 (0.64) LMNATP53MAPTPOLBKDM4E
SCHEMBL1136836 0.82 KDM4E (0.66) LMNAHTTTP53MAPTPOLB
SCHEMBL627613 0.82 LMNA (0.45) LMNAHTTTP53MAPTPOLB
SCHEMBL3373937 0.81 ALDH1A1 (0.55) LMNATP53MAPTPOLBKDM4E
SCHEMBL628437 0.80 LMNA (0.43) LMNAHTTTP53MAPTPOLB
SCHEMBL628421 0.80 LMNA (0.43) LMNAHTTTP53MAPTPOLB
SCHEMBL23028540 0.80 SMN1; SMN2 (0.52) LMNAHTTTP53MAPTPOLB

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
EP-1644368-B1 INDOLYL DERIVATIVES SUBSTITUTED WITH A THIAZOLE RING AND THEIR USE AS PPAR MODULATORS HOFFMANN LA ROCHE (CH) 2008-08-27 EP disclosed
US-7235572-B2 Thiazolyl-indole derivatives, their manufacture and use as pharmaceutical agents HOFFMAN-LA ROCHE INC. (US) 2007-06-26 US disclosed
EP-1644368-A1 INDOLYL DERIVATIVES SUBSTITUTED WITH A THIAZOLE RING AND THEIR USE AS PPAR MODULATORS F. HOFFMANN-LA ROCHE AG (CH) 2006-04-12 EP disclosed
WO-2005005423-A1 INDOLYL DERIVATIVES SUBSTITUTED WITH A THIAZOLE RING AND THEIR USE AS PPAR MODULATORS F. HOFFMANN-LA ROCHE AG (CH) 2005-01-20 WO disclosed
US-20050004187-A1 Thiazolyl-indole derivatives, their manufacture and use as pharmaceutical agents HOFFMANN-LA ROCHE INC. 2005-01-06 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-20050004187-A1 Thiazolyl-indole derivatives, their manufacture and use as pharmaceutical agents PPARD, PPARA, PPARG LMNA 3202/4885HTT 989/4885TP53 1200/4885

“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.