SCHEMBL831407

SCHEMBL831407

Cc1cc2c(cc1C(C)C)S(=O)(=O)CCC2

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 2/20 0.56
LMNA P02545 1/20 0.56
CYP3A4 P08684 1/20 0.34
CYP2C19 P33261 1/20 0.34

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
SCHEMBL11925202 0.74 LMNA (0.67) CYP2C9LMNACYP3A4CYP2C19
SCHEMBL13850170 0.73 CYP2C9 (0.44) CYP2C9LMNACYP3A4CYP2C19
SCHEMBL12915620 0.72 CYP3A4 (0.50) CYP2C9CYP3A4CYP2C19
Meticrane SCHEMBL49070 0.72 CYP2C9 (1.00) CYP2C9LMNA
SCHEMBL19754398 0.71 LMNA (0.51) CYP2C9LMNA
SCHEMBL18237449 0.70 CYP2C9 (0.41) CYP2C9LMNACYP3A4CYP2C19
SCHEMBL19131049 0.70 CYP2C9 (0.41) CYP2C9LMNACYP3A4CYP2C19
SCHEMBL8060691 0.70 LMNA (0.51) CYP2C9LMNA
SCHEMBL11929312 0.70 LMNA (0.70) CYP2C9LMNACYP3A4CYP2C19
SCHEMBL13776031 0.69 LMNA (0.50) CYP2C9LMNA

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-2197842-B1 2, 3-SUBSTITUTED INDOLE DERIVATIVES FOR TREATING VIRAL INFECTIONS SCHERING CORP (US) 2012-05-23 EP disclosed
US-8143305-B2 2,3-substituted indole derivatives for treating viral infections SCHERING CORPORATION (US) 2012-03-27 US disclosed
US-8143305-B2 2,3-substituted indole derivatives for treating viral infections SCHERING CORPORATION (US) 2012-03-27 US disclosed
US-20110033417-A1 2,3-SUBSTITUTED INDOLE DERIVATIVES FOR TREATING VIRAL INFECTIONS MERCK SHARP & DOHME CORP. 2011-02-10 US disclosed
US-20110033417-A1 2,3-SUBSTITUTED INDOLE DERIVATIVES FOR TREATING VIRAL INFECTIONS MERCK SHARP & DOHME CORP. 2011-02-10 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-20110033417-A1 2,3-SUBSTITUTED INDOLE DERIVATIVES FOR TREATING VIRAL INFECTIONS IDO2, IDO1, IRF3 CYP2C9 2171/4885LMNA 3804/4885CYP3A4 666/4885

“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.