SCHEMBL11228846

SCHEMBL11228846

CC(=O)OC1(OC(C)=O)CCCC1C(C)(C)C

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
EP300 Q09472 1/20 0.33
HIF1A Q16665 1/20 0.33
CREBBP Q92793 1/20 0.33
ALOX15 P16050 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
SCHEMBL1931295 0.89 ALOX15 (0.32) ALOX15
SCHEMBL11146106 0.76 ALOX15 (0.39) EP300HIF1ACREBBPALOX15
SCHEMBL1931527 0.76 GAA (0.31) ALOX15
SCHEMBL998437 0.75 ALOX15 (0.39) EP300HIF1ACREBBPALOX15
SCHEMBL11229854 0.74 NPSR1 (0.36) EP300HIF1ACREBBPALOX15
SCHEMBL11233097 0.71 EP300 (0.32) EP300HIF1ACREBBP
SCHEMBL11237036 0.70 EP300 (0.33) EP300HIF1ACREBBPALOX15
SCHEMBL11240219 0.70 EP300 (0.34) EP300HIF1ACREBBP
SCHEMBL11228682 0.69 TDP1 (0.42) EP300HIF1ACREBBP
SCHEMBL11223605 0.69 GAA (0.36) EP300HIF1ACREBBP

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
US-4338458-A Cyclopentane derivatives useful as perfuming agents FIRMENICH SA (CH) 1982-07-06 US disclosed
US-4280934-A Cyclopentane derivatives useful as perfuming agents FIRMENICH SA (CH) 1981-07-28 US disclosed