SCHEMBL31006969

SCHEMBL31006969

CCCCCCCCCCCCOc1cc(CNC(=O)CCCN2CCN(C)CC2)cc(OCCCCCCCCCCCC)c1

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
THRB P10828 3/20 0.54
THRA P10827 1/20 0.54
CNR2 P34972 13/20 0.52
CNR1 P21554 12/20 0.49
NPC1 O15118 1/20 0.48
TP53 P04637 1/20 0.48
HPGD P15428 1/20 0.48
RAB9A P51151 1/20 0.48
EPHX2 P34913 2/20 0.47

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
SCHEMBL31006991 1.00 THRB (0.54) THRBTHRACNR2CNR1NPC1
SCHEMBL31007007 1.00 THRB (0.54) THRBTHRACNR2CNR1NPC1
SCHEMBL31006960 0.81 THRB (0.55) THRBTHRACNR2NPC1TP53
SCHEMBL31006980 0.81 THRB (0.55) THRBTHRACNR2NPC1TP53
SCHEMBL31006982 0.81 THRB (0.55) THRBTHRACNR2NPC1TP53
SCHEMBL31006973 0.81 THRB (0.55) THRBTHRACNR2NPC1TP53
SCHEMBL31006967 0.81 THRB (0.55) THRBTHRACNR2NPC1TP53
SCHEMBL7336231 0.81 THRA (0.57) THRBTHRACNR1NPC1TP53
SCHEMBL31006976 0.81 THRB (0.55) THRBTHRACNR2NPC1TP53
SCHEMBL31007018 0.81 THRB (0.55) THRBTHRACNR2NPC1TP53

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
CN-119233964-A Single component delivery system for nucleic acids 宾夕法尼亚大学理事会 2024-12-31 CN disclosed
US-20240252677-A1 ONE-COMPONENT DELIVERY SYSTEM FOR NUCLEIC ACIDS THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA 2024-08-01 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-20240252677-A1 ONE-COMPONENT DELIVERY SYSTEM FOR NUCLEIC ACIDS TLR3, TLR9, ADAR THRB 4164/4885THRA 2158/4885CNR2 3634/4885

“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.