SCHEMBL27091002

SCHEMBL27091002

CC1(C)OB(c2cnn(CCCCCCNC(=O)O)c2)OC1(C)C

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.50
NAMPT P43490 1/20 0.35
DGAT1 O75907 1/20 0.33
KLKB1 P03952 2/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32

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
SCHEMBL1561022 1.00 FFAR1 (0.50) FFAR1NAMPTDGAT1KLKB1L3MBTL1
SCHEMBL18991402 0.95 FFAR1 (0.52) FFAR1DGAT1KLKB1L3MBTL1CA1
Bicarbonate SCHEMBL18991577 0.93 FFAR1 (0.50) FFAR1DGAT1KLKB1L3MBTL1CA1
Bicarbonate SCHEMBL18991578 0.91 FFAR1 (0.48) FFAR1DGAT1KLKB1L3MBTL1CA1
SCHEMBL17785787 0.90 FFAR1 (0.54) FFAR1DGAT1KLKB1L3MBTL1CA1
SCHEMBL30875416 0.85 FFAR1 (0.50) FFAR1
SCHEMBL12435875 0.85 FFAR1 (0.50) FFAR1
SCHEMBL25248244 0.84 FFAR1 (0.53) FFAR1L3MBTL1
SCHEMBL29236822 0.83 FFAR1 (0.54) FFAR1L3MBTL1
SCHEMBL25258123 0.81 FFAR1 (0.50) FFAR1DGAT1

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-20240050428-A1 COMPOUNDS AND METHODS OF TREATING CANCERS CULLGEN (SHANGHAI), INC. (CN) 2024-02-15 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-20240050428-A1 COMPOUNDS AND METHODS OF TREATING CANCERS GSPT1, GGT1, VHL FFAR1 2382/4885NAMPT 10/4885DGAT1 167/4885

“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.