SCHEMBL11535348

SCHEMBL11535348

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

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
ALDH1A1 P00352 2/20 0.44
L3MBTL1 Q9Y468 1/20 0.39
LMNA P02545 1/20 0.39
ADAMTS5 Q9UNA0 10/20 0.37
MMP2 P08253 5/20 0.37
POLB P06746 1/20 0.36
MAPK1 P28482 1/20 0.36
MMP9 P14780 1/20 0.36
ADAM17 P78536 2/20 0.36
ADAMTS4 O75173 1/20 0.36
MMP13 P45452 2/20 0.35
KDM4E B2RXH2 1/20 0.35
CYP3A4 P08684 1/20 0.35
GABRB3 P28472 1/20 0.35
OPRD1 P41143 1/20 0.35
GABRA2 P47869 1/20 0.35
GABRB2 P47870 1/20 0.35

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
SCHEMBL10574702 0.79 ADAMTS5 (0.42) SMN1; SMN2NPSR1ALDH1A1ADAMTS5MMP2
SCHEMBL2138946 0.79 ADAMTS5 (0.42) SMN1; SMN2NPSR1ALDH1A1ADAMTS5MMP2
SCHEMBL1404438 0.77 SMN1; SMN2 (0.49) SMN1; SMN2NPSR1ALDH1A1LMNAADAMTS5
SCHEMBL27738063 0.75 SMN1; SMN2 (0.47) SMN1; SMN2NPSR1ALDH1A1ADAMTS5MMP2
SCHEMBL29289314 0.75 SMN1; SMN2 (0.47) SMN1; SMN2NPSR1ALDH1A1ADAMTS5MMP2
SCHEMBL6079454 0.75 SMN1; SMN2 (0.47) SMN1; SMN2NPSR1ALDH1A1ADAMTS5MMP2
SCHEMBL11598874 0.75 SMN1; SMN2 (0.47) SMN1; SMN2NPSR1ALDH1A1ADAMTS5MMP2
SCHEMBL6691265 0.73 SMN1; SMN2 (0.46) SMN1; SMN2NPSR1ALDH1A1ADAMTS5MMP2
SCHEMBL5438948 0.72 LMNA (0.57) ALDH1A1LMNAMMP2MMP9MMP13
SCHEMBL11677504 0.72 SMN1; SMN2 (0.45) SMN1; SMN2NPSR1ALDH1A1ADAMTS5MMP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4150234-A WATER RESISTANT CIBA-GEIGY CORPORATION (US) 1979-04-17 US disclosed
US-4137139-A WATER RESISTANT LAMINATES, ADHESIVES, COATINGS CIBA-GEIGY CORPORATION (US) 1979-01-30 US disclosed
US-4071477-A CASTING AND LAMINATING RESINS CIBA-GEIGY CORPORATION (US) 1978-01-31 US disclosed