SCHEMBL6448246

SCHEMBL6448246

CC(C)(CCCCO)CCCCO

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.42
TDP1 Q9NUW8 2/20 0.42
FFAR1 O14842 1/20 0.42
CPT2 P23786 1/20 0.42
CYP4F2 P78329 2/20 0.41
CYP4A11 Q02928 2/20 0.41
ALDH1A1 P00352 3/20 0.40
LMNA P02545 2/20 0.40
TSHR P16473 2/20 0.40
HSD17B10 Q99714 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
ARG2 P78540 1/20 0.31
CNR1 P21554 1/20 0.31
CNR2 P34972 1/20 0.31

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
SCHEMBL20438002 0.97 TDP1 (0.46) SMN1; SMN2TDP1FFAR1CPT2CYP4F2
SCHEMBL15297874 0.97 TDP1 (0.46) SMN1; SMN2TDP1FFAR1CPT2CYP4F2
SCHEMBL20437994 0.97 TDP1 (0.46) SMN1; SMN2TDP1FFAR1CPT2CYP4F2
SCHEMBL20438000 0.97 TDP1 (0.46) SMN1; SMN2TDP1FFAR1CPT2CYP4F2
SCHEMBL12506171 0.94 CYP4F2 (0.39) SMN1; SMN2TDP1FFAR1CPT2CYP4F2
SCHEMBL27902784 0.91 TDP1 (0.42) SMN1; SMN2TDP1FFAR1CPT2CYP4F2
SCHEMBL5184081 0.90 SMN1; SMN2 (0.40) SMN1; SMN2TDP1FFAR1CPT2CYP4F2
SCHEMBL1659019 0.89 SMN1; SMN2 (0.48) SMN1; SMN2TDP1FFAR1CPT2CYP4F2
SCHEMBL1658296 0.89 SMN1; SMN2 (0.55) SMN1; SMN2TDP1FFAR1CPT2CYP4F2
SCHEMBL1657812 0.89 SMN1; SMN2 (0.63) SMN1; SMN2CYP4F2CYP4A11ALDH1A1LMNA

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-20050143599-A1 Process for preparing monoesters 3M INNOVATIVE PROPERTIES COMPANY 2005-06-30 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-20050143599-A1 Process for preparing monoesters ADSL, COASY, AGPS SMN1; SMN2 3677/4885TDP1 2541/4885FFAR1 556/4885

“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.