SCHEMBL4609062

SCHEMBL4609062

C[SiH](C)OC(c1ccccc1C(=O)C1CC1)C(C)(C)C

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 1/20 0.34
HTR3E A5X5Y0 1/20 0.32
HTR3B O95264 1/20 0.32
HTR3A P46098 1/20 0.32
HTR3D Q70Z44 1/20 0.32
HTR3C Q8WXA8 1/20 0.32
SLC6A2 P23975 3/20 0.31
SLC6A4 P31645 3/20 0.31
GLA P06280 1/20 0.31
HTT P42858 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
RECQL P46063 1/20 0.31
PDE10A Q9Y233 1/20 0.31
ALDH1A1 P00352 2/20 0.30
LMNA P02545 1/20 0.30
NPSR1 Q6W5P4 2/20 0.30
TSHR P16473 1/20 0.30
SLC6A3 Q01959 1/20 0.30
KCNH2 Q12809 1/20 0.30
NPC1 O15118 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
SCHEMBL6673750 0.81 ALDH1A1 (0.41) HTTTDP1RECQLALDH1A1TSHR
SCHEMBL4733047 0.76 MEN1 (0.36) ALDH1A1LMNATSHRRAB9A
SCHEMBL7045747 0.75 TRPM8 (0.36) SLC6A2SLC6A4
SCHEMBL4609578 0.73 PDE2A (0.33)
SCHEMBL4609739 0.73 PDE2A (0.33)
SCHEMBL4611395 0.73 PDE2A (0.33)
SCHEMBL1502416 0.72 ALDH1A1 (0.37) PDK2HTR3EHTR3BHTR3AHTR3D
SCHEMBL2769609 0.71 GABRA1 (0.44) TDP1RECQLALDH1A1LMNATSHR
SCHEMBL8681692 0.70 NPC1 (0.36) NPC1RAB9A
SCHEMBL1465848 0.70

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 PDK2 3657/4885HTR3E 1468/4885HTR3B 1493/4885
US-20040006130-A1 Calcium receptor antagonist CALCRL, CASR, CALCR PDK2 3935/4885HTR3E 1662/4885HTR3B 1727/4885

“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.