SCHEMBL23014752

SCHEMBL23014752

CCCOCCCCCCCCCCCCc1ccccc1F

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 3/20 0.44
LIPG Q9Y5X9 1/20 0.41
AOC3 Q16853 1/20 0.41
L3MBTL1 Q9Y468 3/20 0.40
MPO P05164 1/20 0.39
BCHE P06276 3/20 0.38
ACHE P22303 2/20 0.38
IDO1 P14902 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
LTB4R Q15722 1/20 0.36
LTB4R2 Q9NPC1 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
SCHEMBL23014804 0.88 TAAR1 (0.46) TAAR1LIPGAOC3L3MBTL1MPO
SCHEMBL2584935 0.82 LIPG (0.58) TAAR1LIPGAOC3MPOTDP1
SCHEMBL19540033 0.82 LIPG (0.58) TAAR1LIPGAOC3MPOTDP1
SCHEMBL2241863 0.82 LIPG (0.58) TAAR1LIPGAOC3MPOTDP1
SCHEMBL19540031 0.82 LIPG (0.58) TAAR1LIPGAOC3MPOTDP1
SCHEMBL7758952 0.82 LIPG (0.58) TAAR1LIPGAOC3MPOTDP1
SCHEMBL14402389 0.82 LIPG (0.58) TAAR1LIPGAOC3MPOTDP1
SCHEMBL22268936 0.81 TAAR1 (0.44) TAAR1LIPGL3MBTL1BCHEACHE
SCHEMBL16934156 0.80 LIPG (0.52) LIPGBCHEACHE
SCHEMBL9168411 0.80 LIPG (0.56) LIPGBCHEACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220298185-A1 Nucleoside Prodrugs and Uses Related Thereto UNIV EMORY (US) 2022-09-22 US claimed
EP-4017499-A1 NUCLEOSIDE PRODRUGS AND USES RELATED THERETO Emory University (US) 2022-06-29 EP claimed
WO-2021035214-A1 NUCLEOSIDE PRODRUGS AND USES RELATED THERETO EMORY UNIVERSITY (US) 2021-02-25 WO claimed

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-20220298185-A1 Nucleoside Prodrugs and Uses Related Thereto PNPO, GSTO1, CYP2C18 TAAR1 4098/4885LIPG 295/4885AOC3 844/4885

“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.