SCHEMBL9913547

SCHEMBL9913547

CC(C)[Si](C(C)C)(C(C)C)n1ccc2cc(C(O)c3ccccc3C#N)ccc21

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL29237434 0.82 NR3C1 (0.34)
SCHEMBL30967826 0.82 NR3C1 (0.34)
SCHEMBL1466626 0.81 NR3C1 (0.36) ALDH1A1L3MBTL1
SCHEMBL8869444 0.80 LMNA (0.39) ALDH1A1
SCHEMBL7016208 0.76 NR3C1 (0.46) ALDH1A1
SCHEMBL1467101 0.73 NPC1 (0.32)
SCHEMBL2502244 0.67 KDM4E (0.36) ALDH1A1
SCHEMBL29236 0.66 SLC6A2 (0.41) L3MBTL1
SCHEMBL30522140 0.66 TSHR (0.47) ALDH1A1L3MBTL1
SCHEMBL28715842 0.66 TSHR (0.44) ALDH1A1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8198274-B2 Substituted indolyl and indazolyl derivatives and uses thereof ROCHE PALO ALTO LLC (US) 2012-06-12 US disclosed
US-20100016312-A1 Substituted indolyl and indazolyl derivatives and uses thereof ROCHE PALO ALTO LLC 2010-01-21 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-20100016312-A1 Substituted indolyl and indazolyl derivatives and uses thereof MAOB, MAOA, TPH1 ALDH1A1 751/4885L3MBTL1 3032/4885

“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.