SCHEMBL22117342

SCHEMBL22117342

COC(C)(C)CC=CC(C)=CCO

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.32
TDP1 Q9NUW8 2/20 0.32
LMNA P02545 1/20 0.32
CYP3A4 P08684 1/20 0.32
TSHR P16473 1/20 0.30

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
SCHEMBL22117340 1.00 ALDH1A1 (0.32) ALDH1A1TDP1LMNACYP3A4TSHR
SCHEMBL11096588 0.82 ALDH1A1 (0.34) ALDH1A1TDP1LMNACYP3A4TSHR
SCHEMBL11096585 0.82 ALDH1A1 (0.34) ALDH1A1TDP1LMNACYP3A4TSHR
SCHEMBL11706677 0.79
SCHEMBL11706685 0.79
SCHEMBL27487247 0.78
SCHEMBL504504 0.76 ALDH1A1 (0.39) ALDH1A1TDP1LMNACYP3A4TSHR
SCHEMBL504505 0.76 ALDH1A1 (0.39) ALDH1A1TDP1LMNACYP3A4TSHR
SCHEMBL1658557 0.74 ALDH1A1 (0.38) ALDH1A1TDP1TSHR
SCHEMBL1658556 0.74 ALDH1A1 (0.38) ALDH1A1TDP1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3897677-A1 COMPOSITION FOR USE IN A METHOD FOR LOWERING OF LDL-CHOLESTEROL IN PLASMA ezCol B.V. (NL) 2021-10-27 EP disclosed
WO-2020130813-A1 COMPOSITION FOR USE IN A METHOD FOR LOWERING OF LDL-CHOLESTEROL IN PLASMA EZCOL B.V. (NL) 2020-06-25 WO disclosed