SCHEMBL4609336

SCHEMBL4609336

CC(C)(C)[Si](C)(C)OCc1ccccc1C(OCC1CO1)C1CC1

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 1/20 0.35
CASR P41180 6/20 0.34
CYP2D6 P10635 2/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
ALDH1A1 P00352 2/20 0.32
GLA P06280 1/20 0.32
TDP1 Q9NUW8 1/20 0.31
TP53 P04637 2/20 0.31
MAPT P10636 2/20 0.31
HPGD P15428 2/20 0.31
TSHR P16473 2/20 0.31
CYP1A2 P05177 1/20 0.31
PPARG P37231 1/20 0.31
HIF1A Q16665 1/20 0.31

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
SCHEMBL4609334 1.00 BACE1 (0.35) BACE1CASRCYP2D6MEN1KMT2A
SCHEMBL14502747 1.00 BACE1 (0.35) BACE1CASRCYP2D6MEN1KMT2A
SCHEMBL14502746 1.00 BACE1 (0.35) BACE1CASRCYP2D6MEN1KMT2A
SCHEMBL4609571 0.77 BACE1 (0.40) BACE1CASRCYP2D6HIF1A
SCHEMBL4609733 0.77 BACE1 (0.40) BACE1CASRCYP2D6HIF1A
SCHEMBL4609574 0.77 BACE1 (0.40) BACE1CASRCYP2D6HIF1A
SCHEMBL4609594 0.76 ALDH1A1 (0.47) CASRCYP2D6MEN1KMT2AALDH1A1
SCHEMBL14502702 0.76 ALDH1A1 (0.47) CASRCYP2D6MEN1KMT2AALDH1A1
SCHEMBL4609592 0.76 ALDH1A1 (0.47) CASRCYP2D6MEN1KMT2AALDH1A1
SCHEMBL4610221 0.74 ALDH1A1 (0.45) CASRCYP2D6MEN1KMT2AALDH1A1

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
EP-1308436-B1 CALCIUM RECEPTOR ANTAGONISTS JAPAN TOBACCO INC (JP) 2008-10-15 EP disclosed
US-7211685-B2 Calcium receptor antagonists JAPAN TOBACCO INC. (JP) 2007-05-01 US disclosed
US-6916956-B2 Calcium receptor antagonist JAPAN TOBACCO, INC. (JP) 2005-07-12 US disclosed
US-20050107448-A1 Calcium receptor antagonists JAPAN TABACCO INC. 2005-05-19 US disclosed
US-20040006130-A1 Calcium receptor antagonist JAPAN TOBACCO INC (JP) 2004-01-08 US disclosed
EP-1308436-A1 CALCIUM RECEPTOR ANTAGONISTS JAPAN TOBACCO INC. (JP) 2003-05-07 EP 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 (2 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-20050107448-A1 Calcium receptor antagonists CASR, CALCR, CALCRL BACE1 1170/4885CASR 1/4885CYP2D6 497/4885
US-20040006130-A1 Calcium receptor antagonist CALCRL, CASR, CALCR BACE1 1227/4885CASR 2/4885CYP2D6 373/4885

“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.