SCHEMBL24353221

SCHEMBL24353221

COc1cccc(CNc2nc(CN(C)Cc3cccc(OC)c3)nc3sc(C)c(C)c23)c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE4A P27815 1/20 0.45
▸ PDE4B Q07343 1/20 0.45
▸ PDE4C Q08493 1/20 0.45
▸ PDE4D Q08499 1/20 0.45
▸ PDE3B Q13370 1/20 0.45
▸ PDE3A Q14432 1/20 0.45
▸ ALDH1A1 P00352 5/20 0.44
▸ KDM4E B2RXH2 3/20 0.44
▸ LMNA P02545 2/20 0.44
▸ ADORA2A P29274 2/20 0.44
▸ ADORA2B P29275 2/20 0.44
▸ ADORA1 P30542 2/20 0.44
▸ ADORA3 P0DMS8 1/20 0.44
▸ HTT P42858 2/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ TP53 P04637 1/20 0.42
▸ PLA2G1B P04054 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ ATG4B Q9Y4P1 1/20 0.41
▸ HPGD P15428 1/20 0.41

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
SCHEMBL18456744 0.96 ALDH1A1 (0.43) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL24353229 0.96 ALDH1A1 (0.43) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL24353215 0.96 ALDH1A1 (0.46) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL18457051 0.96 ALDH1A1 (0.43) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL24353322 0.96 ALDH1A1 (0.46) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL18457050 0.95 ALDH1A1 (0.42) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL24353182 0.95 ALDH1A1 (0.44) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL24353312 0.95 CLK4 (0.42) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL24353242 0.95 SMN1; SMN2 (0.43) PDE4APDE4BPDE4CPDE4DPDE3B
SCHEMBL24353177 0.95 SMN1; SMN2 (0.43) PDE4APDE4BPDE4CPDE4DPDE3B

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
EP-3324974-B1 COMPOUNDS, COMPOSITIONS, METHODS FOR TREATING DISEASES, AND METHODS FOR PREPARING COMPOUNDS UNIV LOUISVILLE RES FOUND INC (US) 2022-06-08 — — EP disclosed
US-11312690-B2 Compounds, compositions, methods for treating diseases, and methods for preparing compounds UNIVERSITY OF LOUSVILLE RESEARCH FOUNDATION, INC. (US) 2022-04-26 — — 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-11312690-B2 Compounds, compositions, methods for treating diseases, and methods for preparing compounds VHL, C5, KRAS PDE4A 2386/4885PDE4B 1607/4885PDE4C 1287/4885

“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.

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