SCHEMBL9190800

SCHEMBL9190800

CC1(CCCO)NC(=O)NC1=O

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
ALDH1A1 P00352 1/20 0.44
AKR1B1 P15121 1/20 0.40
ADAMTS5 Q9UNA0 16/20 0.40
MMP2 P08253 6/20 0.40
ADAM17 P78536 4/20 0.39
ADAMTS4 O75173 1/20 0.39
MMP13 P45452 2/20 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
SCHEMBL6691265 0.82 SMN1; SMN2 (0.46) SMN1; SMN2NPSR1ALDH1A1AKR1B1ADAMTS5
SCHEMBL11676230 0.80 SMN1; SMN2 (0.45) SMN1; SMN2NPSR1ALDH1A1AKR1B1ADAMTS5
SCHEMBL7553174 0.80 SMN1; SMN2 (0.45) SMN1; SMN2NPSR1ALDH1A1AKR1B1MMP2
SCHEMBL21404017 0.79 ADAMTS5 (0.46) SMN1; SMN2NPSR1ALDH1A1ADAMTS5MMP2
SCHEMBL11146108 0.78 MMP2 (0.46) SMN1; SMN2NPSR1ALDH1A1AKR1B1MMP2
SCHEMBL11484364 0.78 MMP2 (0.46) SMN1; SMN2NPSR1ALDH1A1AKR1B1MMP2
SCHEMBL1404434 0.78 MMP2 (0.46) SMN1; SMN2NPSR1ALDH1A1AKR1B1MMP2
SCHEMBL8893756 0.78 MMP2 (0.46) SMN1; SMN2NPSR1ALDH1A1AKR1B1MMP2
SCHEMBL1404438 0.77 SMN1; SMN2 (0.49) SMN1; SMN2NPSR1ALDH1A1AKR1B1ADAMTS5
SCHEMBL22129834 0.76 SMN1; SMN2 (0.42) SMN1; SMN2NPSR1ALDH1A1AKR1B1ADAMTS5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0571904-B1 Process for preparing methylolhydantoins LONZA AG (US) 1995-10-25 EP disclosed
EP-0571904-A1 Process for preparing methylolhydantoins LONZA INC. (US) 1993-12-01 EP disclosed
US-5252744-A Liquid based methods for the production of solid, anhydrous methylolhydantoins LONZA INC. (US) 1993-10-12 US disclosed
US-4061542-A 2-Methyl-L-arginine produced by cultivating streptomyces strain HOFFMANN-LA ROCHE INC. (US) 1977-12-06 US disclosed