SCHEMBL6088055

SCHEMBL6088055

CCc1c(Sc2cc(C)cc(C)c2)n(Cc2cc(Br)cc(Br)c2)c(=O)[nH]c1=O

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TYMS P04818 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.33
TPH1 P17752 1/20 0.32
TPH2 Q8IWU9 1/20 0.32
LMNA P02545 1/20 0.32
TSHR P16473 3/20 0.32
HPGD P15428 2/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
PKM P14618 1/20 0.31
MAPK1 P28482 2/20 0.31
MAPT P10636 1/20 0.31
ALOX12 P18054 1/20 0.31
BRAF P15056 1/20 0.31
MEN1 O00255 3/20 0.30
KMT2A Q03164 3/20 0.30
KDM4E B2RXH2 1/20 0.30
PSMD14 O00487 1/20 0.30
HTT P42858 1/20 0.30
RXFP1 Q9HBX9 1/20 0.30

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
SCHEMBL6087421 0.92 SMN1; SMN2 (0.37) SMN1; SMN2TPH1TPH2TSHRHPGD
SCHEMBL6085656 0.89 SMN1; SMN2 (0.33) TYMSSMN1; SMN2TPH1TPH2TSHR
SCHEMBL6086770 0.86 GRIN1 (0.37) SMN1; SMN2TPH1TPH2PKMKMT2A
SCHEMBL6086545 0.86 HPGD (0.43) TPH1TPH2TSHRHPGDMAPK1
SCHEMBL6088018 0.84 MTNR1A (0.36) TYMSSMN1; SMN2LMNATSHRHPGD
SCHEMBL6086917 0.84 TSHR (0.34) SMN1; SMN2TPH1TPH2TSHRHPGD
SCHEMBL7854341 0.84 TPH1 (0.33) SMN1; SMN2TPH1TPH2TSHRHPGD
SCHEMBL6086367 0.83 TYMS (0.37) TYMSTSHRHPGDL3MBTL1MAPK1
SCHEMBL7855333 0.81 NR3C1 (0.35) SMN1; SMN2TSHRHPGDMAPK1MEN1
SCHEMBL6086507 0.81 DAO (0.45) SMN1; SMN2TSHRHPGDMAPK1MEN1

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-6987114-B1 Antiviral pyrimidinedione derivatives and process for the preparation thereof SAMJIN PHARMACEUTICAL CO., LTD (KR) 2006-01-17 US disclosed
EP-1100786-A1 ANTIVIRAL PYRIMIDINEDIONE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF Samjin Pharmaceutical Co., Ltd. (KR) 2001-05-23 EP disclosed
WO-2000061564-A1 ANTIVIRAL PYRIMIDINEDIONE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF SAMJIN PHARMACEUTICAL CO., LTD. (KR) 2000-10-19 WO disclosed