SCHEMBL25923178

SCHEMBL25923178

C=CCCCC[C@@H](C)C(C)=O

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.46
ALDH1A1 P00352 5/20 0.46
USP2 O75604 3/20 0.46
CYP3A4 P08684 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
HPGD P15428 1/20 0.46
ABCC4 O15439 1/20 0.42
LMNA P02545 2/20 0.41
RECQL P46063 1/20 0.40
TSHR P16473 2/20 0.38
CA1 P00915 2/20 0.36
PLA2G2C Q5R387 1/20 0.36
LPAR2 Q9HBW0 1/20 0.33
LPAR3 Q9UBY5 1/20 0.33
CYP2C9 P11712 1/20 0.33
FAAH O00519 1/20 0.33
MGLL Q99685 1/20 0.33

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
SCHEMBL3117140 1.00 MAPT (0.46) MAPTALDH1A1USP2CYP3A4SMN1; SMN2
SCHEMBL3127325 0.98 MAPT (0.49) MAPTALDH1A1USP2CYP3A4SMN1; SMN2
SCHEMBL3116277 0.98 MAPT (0.49) MAPTALDH1A1USP2CYP3A4SMN1; SMN2
SCHEMBL3431297 0.98 MAPT (0.49) MAPTALDH1A1USP2CYP3A4SMN1; SMN2
SCHEMBL3120777 0.94 ALDH1A1 (0.40) MAPTALDH1A1USP2CYP3A4SMN1; SMN2
SCHEMBL3116666 0.87
SCHEMBL25923287 0.83 LTA4H (0.48) MAPTALDH1A1USP2CYP3A4SMN1; SMN2
SCHEMBL12564049 0.83 LTA4H (0.48) MAPTALDH1A1USP2CYP3A4SMN1; SMN2
SCHEMBL2700161 0.83 LTA4H (0.48) MAPTALDH1A1USP2CYP3A4SMN1; SMN2
SCHEMBL12153331 0.82 CA1 (0.48) ALDH1A1CA1FAAH

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-20230242482-A9 DISCOVERY, TOTAL SYNTHESIS, AND BIOACTIVITY OF DOSCADENAMIDES UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED (US) 2023-08-03 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-20230242482-A9 DISCOVERY, TOTAL SYNTHESIS, AND BIOACTIVITY OF DOSCADENAMIDES PDE9A, CGAS, PDE8A MAPT 4750/4885ALDH1A1 3972/4885USP2 1846/4885

“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.