SCHEMBL7846207

SCHEMBL7846207

Cc1cc(C)cc(Oc2[nH]c(=O)n(Cc3ccccc3)c(=O)c2C(C)C)c1

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 2/20 0.42
P2RX3 P56373 1/20 0.42
KDM4E B2RXH2 6/20 0.41
ALDH1A1 P00352 4/20 0.41
HPGD P15428 6/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CYP3A4 P08684 1/20 0.41
C5AR1 P21730 1/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
RGS12 O14924 1/20 0.38
USP2 O75604 1/20 0.38
POLB P06746 1/20 0.38
MAPT P10636 1/20 0.38
PSMD14 O00487 1/20 0.37
TSHR P16473 1/20 0.37
HTT P42858 1/20 0.37
TYMS P04818 1/20 0.37

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
SCHEMBL7848800 0.92 KDM4E (0.34) TLR7P2RX3KDM4EALDH1A1C5AR1
SCHEMBL7844132 0.88 ALDH1A1 (0.37) TLR7P2RX3KDM4EALDH1A1SMN1; SMN2
SCHEMBL7837526 0.88 MTNR1A (0.52) KDM4EALDH1A1SMN1; SMN2CYP3A4MEN1
SCHEMBL7835808 0.87 GRIN1 (0.43) CYP3A4MEN1KMT2A
SCHEMBL8393791 0.87 ALDH1A1 (0.46) TLR7P2RX3ALDH1A1
SCHEMBL7843323 0.86 GRIN1 (0.36) TLR7P2RX3KDM4EALDH1A1KMT2A
SCHEMBL7848233 0.86 MTNR1A (0.39) KDM4EALDH1A1MEN1KMT2APOLB
SCHEMBL7847101 0.85 GRIN1 (0.45) TLR7KDM4EALDH1A1HPGD
SCHEMBL7845179 0.84 LMNA (0.39) KDM4EALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL7850053 0.83 GRIN1 (0.49)

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
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
WO-2000061563-A1 ANTIVIRAL PYRIMIDINEDIONE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF SAMJIN PHARMACEUTICAL CO., LTD. (KR) 2000-10-19 WO disclosed