SCHEMBL14788924

SCHEMBL14788924

CCC1(CCCCCF)C(=O)NC(=O)NC1=O

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.57
MMP9 P14780 13/20 0.47
MMP2 P08253 12/20 0.47
MMP8 P22894 11/20 0.47
MMP13 P45452 11/20 0.47
ALDH1A1 P00352 1/20 0.45
MMP3 P08254 1/20 0.38

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
SCHEMBL14782938 1.00 LMNA (0.57) LMNAMMP9MMP2MMP8MMP13
SCHEMBL14788950 0.98 LMNA (0.59) LMNAMMP9MMP2MMP8MMP13
SCHEMBL14788925 0.92 LMNA (0.61) LMNAMMP9MMP2MMP8MMP13
SCHEMBL4379822 0.85 MMP9 (0.63) LMNAMMP9MMP2MMP8MMP13
SCHEMBL4390355 0.85 MMP9 (0.63) LMNAMMP9MMP2MMP8MMP13
SCHEMBL712742 0.85 MMP9 (0.63) LMNAMMP9MMP2MMP8MMP13
SCHEMBL4382583 0.85 MMP9 (0.63) LMNAMMP9MMP2MMP8MMP13
SCHEMBL1641551 0.83 MMP9 (0.61) LMNAMMP9MMP2MMP8MMP13
SCHEMBL918796 0.82 LMNA (0.64) LMNAMMP9MMP2MMP8MMP13
SCHEMBL14782791 0.81 LMNA (0.57) LMNAMMP9MMP2MMP8MMP13

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
WO-2013038153-A1 18F-LABELLED BARBITURATE COMPOUNDS FOR USE AS POSITRON EMISSION IMAGING AGENTS THE UNIVERSITY COURT OF THE UNIVERSITY OF ABERDEEN (GB) 2013-03-21 WO disclosed