SCHEMBL9945962

SCHEMBL9945962

CB(O)c1ccc(CCC(=O)O)cc1

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 13/20 0.57
KEAP1 Q14145 1/20 0.55
FFAR4 Q5NUL3 2/20 0.49
LMNA P02545 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49
P4HTM Q9NXG6 1/20 0.47
ALDH1A1 P00352 1/20 0.46
RXRA P19793 1/20 0.46
RXRB P28702 1/20 0.46
RXRG P48443 1/20 0.46

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
SCHEMBL363489 0.84 FFAR1 (0.61) FFAR1KEAP1FFAR4CA1CA2
SCHEMBL69746 0.81 FFAR1 (0.81) FFAR1KEAP1FFAR4LMNAL3MBTL1
Hydrochloric Acid SCHEMBL25264643 0.79 FFAR1 (0.77) FFAR1KEAP1FFAR4LMNAL3MBTL1
SCHEMBL1206896 0.75 FFAR1 (0.65) FFAR1KEAP1FFAR4LMNAL3MBTL1
SCHEMBL169770 0.75 FFAR1 (0.79) FFAR1KEAP1FFAR4LMNAL3MBTL1
SCHEMBL193318 0.75 FFAR1 (0.79) FFAR1KEAP1FFAR4CA1CA2
SCHEMBL1206798 0.75 L3MBTL1 (0.69) FFAR1KEAP1FFAR4LMNAL3MBTL1
SCHEMBL9945963 0.75 LPL (0.72) L3MBTL1CA1CA2
SCHEMBL3533619 0.74 FFAR1 (0.87) FFAR1KEAP1FFAR4LMNAL3MBTL1
SCHEMBL11424035 0.74 FFAR1 (0.71) FFAR1KEAP1FFAR4CA1CA2

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-20120149693-A1 THERAPEUTIC COMPOUNDS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INC. (US) 2012-06-14 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-20120149693-A1 THERAPEUTIC COMPOUNDS HTR2C, GRK2, GRK3 FFAR1 1083/4885KEAP1 1115/4885FFAR4 1371/4885

“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.