SCHEMBL25565724

SCHEMBL25565724

CCn1cc(COC(=O)C(C)C)nn1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.52
▸ ALOX5 P09917 3/20 0.42
▸ GLA P06280 1/20 0.42
▸ PTGS2 P35354 3/20 0.40
▸ NPC1 O15118 2/20 0.38
▸ HSP90AB1 P08238 1/20 0.37
▸ CYP1A2 P05177 2/20 0.37
▸ CYP2C9 P11712 2/20 0.37
▸ CYP2C19 P33261 2/20 0.37
▸ CYP3A4 P08684 1/20 0.37
▸ CYP2D6 P10635 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ KMT2A Q03164 1/20 0.36

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
SCHEMBL25565777 0.88 ALDH1A1 (0.50) ALDH1A1ALOX5GLA
SCHEMBL23341749 0.81 NPC1 (0.45) ALDH1A1ALOX5GLAPTGS2NPC1
SCHEMBL16221704 0.80 ALOX5 (0.41) ALDH1A1ALOX5NPC1HSP90AB1CYP1A2
SCHEMBL22803422 0.79 DGAT1 (0.41) HSP90AB1
SCHEMBL20362413 0.78 CYP1A2 (0.40) CYP1A2
SCHEMBL20953397 0.77 CYP19A1 (0.36) HSP90AB1
SCHEMBL20711246 0.76 KDM4E (0.35) ALDH1A1GLACYP1A2CYP2C9CYP2C19
SCHEMBL20694373 0.76 HSP90AB1 (0.41) ALOX5HSP90AB1
SCHEMBL15431475 0.76 ALOX5 (0.36) ALDH1A1ALOX5GLANPC1HSP90AB1
SCHEMBL20694535 0.75 DGAT1 (0.40) HSP90AB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230149562-A1 CARRIERS FOR EFFICIENT NUCLEIC ACID DELIVERY TIBA BIOTECH LLC (US) 2023-05-18 — — 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-20230149562-A1 CARRIERS FOR EFFICIENT NUCLEIC ACID DELIVERY POLN, TLR9, TSG101 ALDH1A1 3979/4885ALOX5 4067/4885GLA 3196/4885

“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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