SCHEMBL1145899

SCHEMBL1145899

OCc1cc(C(c2ccc(O)c(CO)c2)c2ccc(O)c(CO)c2)ccc1O

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 15/20 0.54
CYP1A2 P05177 1/20 0.53
CYP2D6 P10635 1/20 0.53
TSHR P16473 1/20 0.53
NFKB1 P19838 1/20 0.53
HIF1A Q16665 1/20 0.53
ADRB1 P08588 1/20 0.53
TDP1 Q9NUW8 1/20 0.51
KLF10 Q13118 1/20 0.48
PKM P14618 1/20 0.47
PMP22 Q01453 1/20 0.46

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
SCHEMBL14255720 0.92 ADRB2 (0.49) ADRB2CYP1A2CYP2D6TSHRNFKB1
SCHEMBL13181489 0.86 ADRB2 (0.47) ADRB2CYP1A2CYP2D6TSHRNFKB1
SCHEMBL12866429 0.84 ADRB2 (0.46) ADRB2CYP1A2CYP2D6TSHRNFKB1
SCHEMBL17635440 0.83 ADRB2 (0.48) ADRB2CYP1A2CYP2D6TSHRNFKB1
SCHEMBL10215349 0.83 ADRB2 (0.54) ADRB2CYP1A2CYP2D6TSHRNFKB1
SCHEMBL10450797 0.81 ADRB2 (0.57) ADRB2CYP1A2CYP2D6TSHRNFKB1
SCHEMBL22607306 0.81 ADRB2 (0.57) ADRB2CYP1A2CYP2D6TSHRNFKB1
SCHEMBL14622394 0.81 ADRB2 (0.54) ADRB2CYP1A2CYP2D6TSHRNFKB1
SCHEMBL14220262 0.81 ADRB2 (0.57) ADRB2CYP1A2CYP2D6TSHRNFKB1
SCHEMBL19983517 0.80 ADRB2 (0.45) ADRB2CYP1A2CYP2D6TSHRNFKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2175863-A2 SUBSTITUTED NUCLEOSIDE DERIVATIVES WITH ANTIVIRAL AND ANTIMICROBIAL PROPERTIES Eastern Virginia Medical School (US) 2010-04-21 EP claimed
WO-2009009625-A2 SUBSTITUTED NUCLEOSIDE DERIVATIVES WITH ANTIVIRAL AND ANTIMICROBIAL PROPERTIES EASTERN VIRGINIA MEDICAL SCHOOL (US) 2009-01-15 WO claimed
US-20230173077-A1 FATTY ACYL AND FATTY ETHER CONJUGATES OF REMDESIVIR AND ITS ACTIVE METABOLITES AS ANTIVIRALS AJK Biopharmaceutical, LLC 2023-06-08 US disclosed
WO-2021222807-A1 FATTY ACYL AND FATTY ETHER CONJUGATES OF REMDESIVIR AND ITS ACTIVE METABOLITES AS ANTIVIRALS AJK PHARMACEUTICAL LLC (US) 2021-11-04 WO disclosed
US-9738678-B2 Substituted nucleoside derivatives with antiviral and antimicrobial properties EASTERN VIRGINIA MEDICAL SCHOOL (US) 2017-08-22 US disclosed
US-20160311843-A1 SUBSTITUTED NUCLEOSIDE DERIVATIVES WITH ANTIVIRAL AND ANTIMICROBIAL PROPERTIES EASTERN VIRGINIA MEDICAL SCHOOL (US) 2016-10-27 US disclosed
US-9296776-B2 Substituted nucleoside derivatives with antiviral and antimicrobial properties EASTERN VIRGINIA MEDICAL SCHOOL (US) 2016-03-29 US disclosed
US-20110039798-A1 SUBSTITUTED NUCLEOSIDE DERIVATIVES WITH ANTIVIRAL AND ANTIMICROBIAL PROPERTIES EASTERN VIRGINIA MEDICAL SCHOOL (US) 2011-02-17 US disclosed
EP-2175863-A2 SUBSTITUTED NUCLEOSIDE DERIVATIVES WITH ANTIVIRAL AND ANTIMICROBIAL PROPERTIES Eastern Virginia Medical School (US) 2010-04-21 EP disclosed
WO-2009009625-A2 SUBSTITUTED NUCLEOSIDE DERIVATIVES WITH ANTIVIRAL AND ANTIMICROBIAL PROPERTIES EASTERN VIRGINIA MEDICAL SCHOOL (US) 2009-01-15 WO disclosed
WO-2009009625-A2 SUBSTITUTED NUCLEOSIDE DERIVATIVES WITH ANTIVIRAL AND ANTIMICROBIAL PROPERTIES EASTERN VIRGINIA MEDICAL SCHOOL (US) 2009-01-15 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 (3 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-20230173077-A1 FATTY ACYL AND FATTY ETHER CONJUGATES OF REMDESIVIR AND ITS ACTIVE METABOLITES AS ANTIVIRALS ELOVL6, FADS2, FASN ADRB2 3545/4885CYP1A2 148/4885CYP2D6 71/4885
US-20110039798-A1 SUBSTITUTED NUCLEOSIDE DERIVATIVES WITH ANTIVIRAL AND ANTIMICROBIAL PROPERTIES SAMHD1, TLR3, MAVS ADRB2 4016/4885CYP1A2 4420/4885CYP2D6 4405/4885
US-20160311843-A1 SUBSTITUTED NUCLEOSIDE DERIVATIVES WITH ANTIVIRAL AND ANTIMICROBIAL PROPERTIES SAMHD1, TLR3, MAVS ADRB2 4016/4885CYP1A2 4420/4885CYP2D6 4405/4885

“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.