SCHEMBL5000975

SCHEMBL5000975

CC(C)(C)[Si](C)(C)OCc1cc(Cl)ccc1N=C=S

nearest known ligand 0.30

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 1/20 0.30
MEN1 O00255 1/20 0.30
PKM P14618 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL1922496 0.84 NAAA (0.33) BACE1
SCHEMBL1922927 0.79 ALDH1A1 (0.32) MEN1KMT2A
SCHEMBL22678373 0.76 MRGPRX4 (0.38) BACE1MEN1PKMKMT2A
SCHEMBL4996802 0.75 IDO1 (0.38) BACE1MEN1PKMKMT2A
SCHEMBL22517612 0.75 KDM5A (0.40) BACE1MEN1PKMKMT2A
SCHEMBL29383016 0.75 NOS3 (0.36) BACE1MEN1PKMKMT2A
SCHEMBL5373425 0.75 MEN1 (0.49) BACE1MEN1PKMKMT2A
SCHEMBL8936718 0.75 NOS3 (0.36) BACE1MEN1PKMKMT2A
SCHEMBL14008752 0.74 GABRA1 (0.50) MEN1KMT2A
SCHEMBL23322944 0.72 ALDH1A1 (0.34) BACE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7456170-B2 Triazolobenzodiazepines and their use as vasopressin antagonists PFIZER INC. (US) 2008-11-25 US disclosed
US-7456170-B2 Triazolobenzodiazepines and their use as vasopressin antagonists PFIZER INC. (US) 2008-11-25 US disclosed
US-20070249585-A1 Triazolobenzodiazepines and Their Use as Vasopressin Antagonists PFIZER INC. 2007-10-25 US disclosed
US-20070249585-A1 Triazolobenzodiazepines and Their Use as Vasopressin Antagonists PFIZER INC. 2007-10-25 US disclosed
EP-1784408-A1 TRIAZOLOBENZODIAZEPINES AND THEIR USE AS VASOPRESSIN ANTAGONISTS Pfizer Limited (GB) 2007-05-16 EP disclosed
WO-2006021882-A1 TRIAZOLOBENZODIAZEPINES AND THEIR USE AS VASOPRESSIN ANTAGONISTS PFIZER LIMITED (GB) 2006-03-02 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 (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-20070249585-A1 Triazolobenzodiazepines and Their Use as Vasopressin Antagonists AVPR2, AVPR1A, AVPR1B BACE1 2994/4885MEN1 915/4885PKM 1513/4885

“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.