SCHEMBL5147487

SCHEMBL5147487

CC(CC1(CC(C)Nc2nccc(-c3ccc(S(=O)(=O)N4CCCCC4C)s3)n2)NC(=O)NC1=O)Nc1nccc(-c2ccc(S(=O)(=O)N3CCCCC3C)s2)n1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.34
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CDK4 P11802 6/20 0.33
CCND1 P24385 6/20 0.33
CCND3 P30281 6/20 0.33
CDK6 Q00534 6/20 0.33
CCNT1 O60563 5/20 0.33
CDK7 P50613 5/20 0.33
CDK9 P50750 5/20 0.33
CCNH P51946 5/20 0.33
CCNA2 P20248 4/20 0.33
CDK2 P24941 4/20 0.33
CDK1 P06493 3/20 0.33
CCNB1 P14635 3/20 0.33
MMP3 P08254 2/20 0.33
MMP1 P03956 1/20 0.33
MMP2 P08253 1/20 0.33
MMP7 P09237 1/20 0.33

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
SCHEMBL5147314 0.77 DHODH (0.41) MAPK8MAPK13MAPK12MAPK11MAPK14
SCHEMBL2980393 0.75 MMP3 (0.35) ALOX15ALDH1A1LMNASMN1; SMN2CDK4
SCHEMBL2986658 0.74 BRAF (0.45) ALOX15ALDH1A1LMNASMN1; SMN2MMP3
SCHEMBL2984187 0.73 BRAF (0.43) ALOX15ALDH1A1LMNASMN1; SMN2MMP3
SCHEMBL5147445 0.73 AKT3 (0.40)
SCHEMBL5147362 0.72 ALDH1A1 (0.43) ALDH1A1LMNASMN1; SMN2CDK9KMT2A
SCHEMBL2988685 0.72 ALOX15 (0.45) ALOX15ALDH1A1LMNASMN1; SMN2MMP3
SCHEMBL5147389 0.72 DHODH (0.34) ALDH1A1LMNAMAPK8MAPK13MAPK12
SCHEMBL2986562 0.70 HPGD (0.37) ALOX15ALDH1A1LMNASMN1; SMN2MMP3
SCHEMBL5147411 0.69 DHODH (0.34) ALDH1A1LMNA

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-1831207-A1 AMINOPYRIMIDINE COMPOUNDS AND METHODS OF USE Amgen Inc. (US) 2007-09-12 EP disclosed
WO-2006066172-A1 AMINOPYRIMIDINE COMPOUNDS AND METHODS OF USE AMGEN, INC. (US) 2006-06-22 WO disclosed