SCHEMBL2320071

SCHEMBL2320071

COc1c(-c2ccc3cc(NS(C)(=O)=O)ccc3c2)cc(-n2c(=O)cc[nH]c2=O)cc1-c1ccc(C)s1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 1/20 0.48
BRD4 O60885 5/20 0.35
PIP4K2A P48426 2/20 0.33
PIP4K2B P78356 2/20 0.33
CYP17A1 P05093 2/20 0.33
BRPF1 P55201 1/20 0.33
DRD2 P14416 1/20 0.33
HTR2A P28223 1/20 0.33
HTR2C P28335 1/20 0.33
DRD3 P35462 1/20 0.33
HTR6 P50406 1/20 0.33
TP53 P04637 1/20 0.33
IKBKB O14920 1/20 0.33
CHUK O15111 1/20 0.33
RIPK2 O43353 1/20 0.32
ACVR1 Q04771 1/20 0.32
NOD2 Q9HC29 1/20 0.32
PRF1 P14222 1/20 0.32
PTK2 Q05397 1/20 0.32
JAK2 O60674 1/20 0.32

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
SCHEMBL2913210 0.87 CRBN (0.48) CRBNBRD4BRPF1IKBKBCHUK
SCHEMBL2914093 0.86 CRBN (0.52) CRBNBRD4BRPF1IKBKBCHUK
SCHEMBL2913138 0.85 CRBN (0.53) CRBNBRD4PIP4K2APIP4K2BBRPF1
SCHEMBL2915237 0.85 CRBN (0.49) CRBNBRD4PIP4K2APIP4K2BBRPF1
SCHEMBL2911158 0.85 CRBN (0.52) CRBNBRD4PIP4K2APIP4K2BBRPF1
SCHEMBL2915591 0.85 CRBN (0.52) CRBNBRD4PIP4K2APIP4K2BBRPF1
SCHEMBL2913874 0.85 CRBN (0.54) CRBNBRD4PIP4K2APIP4K2BBRPF1
SCHEMBL2912947 0.84 CRBN (0.48) CRBNBRD4PIP4K2APIP4K2BCYP17A1
SCHEMBL2913845 0.83 CRBN (0.49) CRBNBRD4PTK2JAK2JAK1
SCHEMBL2910644 0.83 CRBN (0.49) CRBNBRD4PIP4K2APIP4K2BBRPF1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2203431-B1 ANTI-INFECTIVE PYRIMIDINES AND USES THEREOF ABBOTT LAB (US) 2011-08-10 EP disclosed
EP-2222646-A1 URACIL OR THYMINE DERIVATIVE FOR TREATING HEPATITIS C Abbott Laboratories (US) 2010-09-01 EP disclosed
EP-2203431-A1 ANTI-INFECTIVE PYRIMIDINES AND USES THEREOF Abbott Laboratories (US) 2010-07-07 EP disclosed
WO-2009039127-A1 URACIL OR THYMINE DERIVATIVE FOR TREATING HEPATITIS C ABBOTT LABORATORIES (US) 2009-03-26 WO disclosed
WO-2009039134-A1 ANTI-INFECTIVE PYRIMIDINES AND USES THEREOF ABBOTT LABORATORIES (US) 2009-03-26 WO disclosed