SCHEMBL7854604

SCHEMBL7854604

CCCCCn1c(=O)[nH]c(C(=O)c2cc(C)cc(C)c2)c(CC)c1=O

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.49
TP53 P04637 3/20 0.49
GAA P10253 4/20 0.46
KDM4E B2RXH2 3/20 0.46
HSD17B10 Q99714 3/20 0.46
ALDH1A1 P00352 2/20 0.46
HPGD P15428 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.43
GLA P06280 3/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
LMNA P02545 1/20 0.41
POLB P06746 4/20 0.39
RXFP1 Q9HBX9 2/20 0.38
USP2 O75604 2/20 0.38
HTT P42858 1/20 0.38
PKM P14618 1/20 0.38
KEAP1 Q14145 1/20 0.38
NFE2L2 Q16236 1/20 0.38

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
SCHEMBL7846211 0.84 MEN1 (0.36) MAPTTP53ALDH1A1SMN1; SMN2MEN1
SCHEMBL8337012 0.81 MAPT (0.35) MAPTTP53ALDH1A1SMN1; SMN2MEN1
SCHEMBL9009353 0.81 USP2 (0.38) MAPTGAAKDM4EHSD17B10ALDH1A1
SCHEMBL8182725 0.80 GRIN1 (0.42) MAPTTP53KDM4EHSD17B10ALDH1A1
SCHEMBL9009363 0.80 TPH1 (0.34) MAPTTP53ALDH1A1SMN1; SMN2MEN1
SCHEMBL9009425 0.79 MEN1 (0.33) MAPTTP53ALDH1A1SMN1; SMN2MEN1
SCHEMBL8338415 0.79 ALDH1A1 (0.45) MAPTKDM4EHSD17B10ALDH1A1HPGD
SCHEMBL7848458 0.78 MAPT (0.36) MAPTTP53KDM4EALDH1A1SMN1; SMN2
SCHEMBL7847521 0.78 LMNA (0.41) MAPTGAAKDM4EALDH1A1SMN1; SMN2
SCHEMBL7844325 0.78 TYMS (0.35) MAPTTP53ALDH1A1SMN1; SMN2MEN1

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-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