SCHEMBL2910190

SCHEMBL2910190

CC(C)(C)c1cc(N2C(=O)CCNC2=O)cc(C(=O)Nc2ccc(NS(=O)(=O)c3ccccc3)cc2)c1O

nearest known ligand 0.42

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GPR27 Q9NS67 17/20 0.42
AVPR2 P30518 6/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL2912963 0.89 ALDH1A1 (0.42) MEN1KMT2A
SCHEMBL2913166 0.89 XDH (0.38) MEN1KMT2A
SCHEMBL2913446 0.85 ALDH1A1 (0.36) MEN1KMT2A
SCHEMBL2907832 0.84 BCL2L1 (0.34)
SCHEMBL2913154 0.84 BCL2L1 (0.35)
SCHEMBL2915315 0.83 KIF18A (0.35)
SCHEMBL2907657 0.83 MAPT (0.45) MEN1KMT2A
SCHEMBL2910683 0.83 ALDH1A1 (0.36)
SCHEMBL2908073 0.82 NR1H4 (0.47) MEN1KMT2A
SCHEMBL2910962 0.82 RAB9A (0.39) MEN1KMT2A

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-2222646-A1 URACIL OR THYMINE DERIVATIVE FOR TREATING HEPATITIS C Abbott Laboratories (US) 2010-09-01 EP disclosed
WO-2009039127-A1 URACIL OR THYMINE DERIVATIVE FOR TREATING HEPATITIS C ABBOTT LABORATORIES (US) 2009-03-26 WO disclosed