SCHEMBL7143333

SCHEMBL7143333

CC1CCCCCCCCCCCCCCC(=O)C1.CCC1CCCCCCCCCCC(=O)CC1

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.39
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA4 P22748 1/20 0.36
TRIM24 O15164 2/20 0.35
TRIM33 Q9UPN9 2/20 0.35
ALDH1A1 P00352 1/20 0.35
HTT P42858 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
SCHEMBL4424531 0.88 TRIM24 (0.46) KMT2ACA1CA2CA4TRIM24
SCHEMBL2692193 0.86 TRIM24 (0.43) KMT2ACA1CA2CA4TRIM24
SCHEMBL7145748 0.86 TRIM24 (0.34) KMT2ACA1CA2CA4TRIM24
SCHEMBL7065377 0.84 TRIM24 (0.50) KMT2ACA1CA2CA4TRIM24
SCHEMBL6242823 0.84 TRIM24 (0.50) KMT2ACA1CA2CA4TRIM24
SCHEMBL11796568 0.84 TRIM24 (0.50) KMT2ACA1CA2CA4TRIM24
SCHEMBL6245099 0.84 TRIM24 (0.50) KMT2ACA1CA2CA4TRIM24
SCHEMBL24304032 0.82 KMT2A (0.54) KMT2ACA1CA2CA4TRIM24
SCHEMBL316736 0.82 KMT2A (0.54) KMT2ACA1CA2CA4TRIM24
SCHEMBL230871 0.82 KMT2A (0.54) KMT2ACA1CA2CA4TRIM24

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-1362023-A1 METHOD FOR PRODUCING MACROCYCLIC KETONES Givaudan SA (CH) 2003-11-19 EP claimed
WO-2002068372-A1 METHOD FOR PRODUCING MACROCYCLIC KETONES GIVAUDAN SA (CH) 2002-09-06 WO claimed