Ether

Ether

SCHEMBL4959618

CC(C)(C)[Si](C)(C)OCCCOc1ccc(CO)cc1.CCOCC

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 1/20 0.39
ALDH1A1 P00352 3/20 0.37
SMN1; SMN2 Q16637 3/20 0.37
LMNA P02545 2/20 0.37
MEN1 O00255 1/20 0.37
USP2 O75604 1/20 0.37
CYP3A4 P08684 1/20 0.37
MAPK1 P28482 1/20 0.37
CASP1 P29466 1/20 0.37
KMT2A Q03164 1/20 0.37
SLCO1B3 Q9NPD5 1/20 0.37
SLCO1B1 Q9Y6L6 1/20 0.37
POLB P06746 1/20 0.36
PPARG P37231 1/20 0.36
PPARA Q07869 1/20 0.36
HTT P42858 1/20 0.36
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35
DUT P33316 1/20 0.35
CYP1A2 P05177 2/20 0.34

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
SCHEMBL1629693 0.93 HRH3 (0.43) HRH3ALDH1A1SMN1; SMN2LMNAMEN1
SCHEMBL1627357 0.90 HRH3 (0.43) HRH3SMN1; SMN2CYP3A4POLBPPARG
SCHEMBL662362 0.86 PPARG (0.41) HRH3ALDH1A1SMN1; SMN2LMNAMEN1
SCHEMBL4959621 0.81 DUT (0.39) HRH3ALDH1A1SMN1; SMN2LMNAMAPT
SCHEMBL3079743 0.79 DUT (0.36) PPARGDUT
SCHEMBL25369942 0.78 LTA4H (0.50) LMNACYP3A4DUTCYP1A2CYP2D6
SCHEMBL662532 0.78 DUT (0.40) ALDH1A1SMN1; SMN2LMNAMEN1USP2
SCHEMBL1627173 0.77 DUT (0.40) ALDH1A1SMN1; SMN2LMNAMEN1USP2
SCHEMBL15827693 0.76 CYP3A4 (0.44) ALDH1A1SMN1; SMN2LMNAMEN1USP2
SCHEMBL20568979 0.75 APP (0.41) ALDH1A1SMN1; SMN2CYP3A4DUTCYP1A2

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-8226929-B2 Administering to a patient a contrast agent (pyridimifen, fenazaquin) which comprises a compound that binds MC-1, and an imaging moiety, and scanning the patient using diagnostic imaging LANTHEUS MEDICAL IMAGING, INC. (US) 2012-07-24 US disclosed
US-20080112884-A1 CONTRAST AGENTS FOR MYOCARDIAL PERFUSION IMAGING BRISTOL-MYERS SQUIBB PHARMA COMPANY 2008-05-15 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-20080112884-A1 CONTRAST AGENTS FOR MYOCARDIAL PERFUSION IMAGING TNNI3, TNNT2, FABP3 HRH3 3066/4885ALDH1A1 2228/4885SMN1; SMN2 2969/4885

“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.