SCHEMBL19215848

SCHEMBL19215848

CC(C)(C)SC1CCCCCC(=O)CCCC1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TRIM24 O15164 2/20 0.44
TRIM33 Q9UPN9 2/20 0.44
ALDH1A1 P00352 2/20 0.44
KMT2A Q03164 1/20 0.38
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA4 P22748 1/20 0.34
MAPT P10636 1/20 0.30
PKM P14618 1/20 0.30
HPGD P15428 1/20 0.30
ALOX15 P16050 1/20 0.30
ALOX12 P18054 1/20 0.30
MC4R P32245 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL17999055 0.98 TRIM24 (0.42) TRIM24TRIM33ALDH1A1KMT2ACA1
SCHEMBL16254088 0.98 TRIM24 (0.42) TRIM24TRIM33ALDH1A1KMT2ACA1
SCHEMBL15029268 0.94 TRIM24 (0.39) TRIM24TRIM33ALDH1A1KMT2ACA1
SCHEMBL21049495 0.83
SCHEMBL12892360 0.82
SCHEMBL15271174 0.82
SCHEMBL10245165 0.80
Cyclohexanone SCHEMBL27711712 0.76 TRIM24 (0.55) TRIM24TRIM33ALDH1A1KMT2ACA1
SCHEMBL15270684 0.75
SCHEMBL16578106 0.72 TSHR (0.46)

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
EP-3004098-B1 KINASE INHIBITORS CHIESI FARM SPA (IT) 2017-08-09 EP disclosed