SCHEMBL14926985

SCHEMBL14926985

COc1ccc(-c2cc3c(-c4ccccc4)c(CO)c(CO)cc3c(N(C)C)n2)cc1OC

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 5/20 0.54
PDE4A P27815 5/20 0.54
PDE4B Q07343 5/20 0.54
PDE4C Q08493 5/20 0.54
PDE4D Q08499 5/20 0.54
PDE3B Q13370 5/20 0.54
PDE3A Q14432 5/20 0.54
PDE1A P54750 4/20 0.54
PDE1B Q01064 4/20 0.54
PDE1C Q14123 4/20 0.54
ACACA Q13085 1/20 0.50
KMT2A Q03164 5/20 0.45
KDM4E B2RXH2 5/20 0.45
ALDH1A1 P00352 5/20 0.45
HPGD P15428 4/20 0.45
MEN1 O00255 3/20 0.45
HSD17B10 Q99714 3/20 0.45
TSHR P16473 2/20 0.45
MAPK1 P28482 2/20 0.45
USP2 O75604 1/20 0.45

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
SCHEMBL14926991 0.83 HSD17B10 (0.48) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL14903963 0.81 PDE5A (0.53) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL12070525 0.81 KDM4E (0.50) ACACAKMT2AKDM4EALDH1A1HPGD
SCHEMBL14926983 0.78 PDE4A (0.51) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL14903966 0.76 ACACA (0.47) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL14903975 0.75 PDE5A (0.55) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL12070532 0.75 L3MBTL1 (0.53) PDE4APDE4BPDE4CPDE4DACACA
SCHEMBL14903964 0.73 PDE5A (0.49) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL14926989 0.70 KMT2A (0.42) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL14904332 0.70 PDE4A (0.54) PDE5APDE4APDE4BPDE4CPDE4D

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-8933096-B2 Antimicrobial agents Rugers, The State University of New Jersey (US) 2015-01-13 US disclosed
US-20130116278-A1 ANTIMICROBIAL AGENTS RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY 2013-05-09 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-20130116278-A1 ANTIMICROBIAL AGENTS MRPL21, ARG1, RPP30 PDE5A 2129/4885PDE4A 2153/4885PDE4B 2021/4885

“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.