SCHEMBL925384

SCHEMBL925384

CC(C)(C)C=C[C@H](O[Si](C)(C)C(C)(C)C)[C@H](Cc1ccccc1)NC(=O)O

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.36
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
ACE P12821 2/20 0.34
ATM Q13315 1/20 0.34
BCHE P06276 1/20 0.34
KLK5 Q9Y337 1/20 0.34
POLB P06746 1/20 0.34
MAPT P10636 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
TAAR1 Q96RJ0 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
MME P08473 1/20 0.34
ACE2 Q9BYF1 1/20 0.34
CTRB1 P17538 1/20 0.34
BACE1 P56817 1/20 0.34
CTSS P25774 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
SCHEMBL927525 0.90 NPC1 (0.38) KMT2ANPC1RAB9AATMBCHE
SCHEMBL927524 0.90 NPC1 (0.38) KMT2ANPC1RAB9AATMBCHE
SCHEMBL927526 0.90 NPC1 (0.38) KMT2ANPC1RAB9AATMBCHE
SCHEMBL924795 0.87 ATM (0.39) KMT2ANPC1RAB9AATMBCHE
SCHEMBL924796 0.87 ATM (0.39) KMT2ANPC1RAB9AATMBCHE
SCHEMBL9658726 0.79 KLK5 (0.49) KMT2ARAB9AACEATMKLK5
SCHEMBL9657327 0.78 KLK5 (0.47) KMT2ARAB9AACEATMKLK5
SCHEMBL7362380 0.78 KLK5 (0.47) KMT2ARAB9AACEATMKLK5
SCHEMBL924912 0.78 NPC1 (0.42) KMT2ANPC1RAB9AL3MBTL1ACE
SCHEMBL925424 0.78 MAPT (0.39) KMT2ANPC1RAB9AACEATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8163766-B2 Beta-secretase modulators and methods of use AMGEN INC. (US) 2012-04-24 US disclosed
US-20110118250-A1 BETA-SECRETASE MODULATORS AND METHODS OF USE AMGEN INC. (US) 2011-05-19 US disclosed
US-7872009-B2 Beta-Secretase modulators and methods of use AMGEN INC. (US) 2011-01-18 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-20110118250-A1 BETA-SECRETASE MODULATORS AND METHODS OF USE BACE1, BACE2, APP KMT2A 3113/4885NPC1 1445/4885RAB9A 1606/4885

“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.