SCHEMBL8340328

SCHEMBL8340328

Cc1cc(C)cc(C(=O)c2[nH]c(=O)n(CCC3CC=CC3)c(=O)c2C(C)C)c1

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.33
MAPT P10636 1/20 0.33
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
ALDH1A1 P00352 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
GRIN1 Q05586 1/20 0.31
GRIN2B Q13224 1/20 0.31
TDP1 Q9NUW8 1/20 0.30
KDM4E B2RXH2 1/20 0.30
GLA P06280 1/20 0.30
GAA P10253 1/20 0.30
HPGD P15428 1/20 0.30
HSD17B10 Q99714 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
SCHEMBL8530286 0.89 GRIN1 (0.34) MEN1KMT2AALDH1A1SMN1; SMN2GRIN1
SCHEMBL8337012 0.85 MAPT (0.35) TP53MAPTMEN1KMT2AALDH1A1
SCHEMBL8336258 0.85 USP2 (0.30) ALDH1A1GRIN1GRIN2BTDP1
SCHEMBL8340329 0.83 KMT2A (0.36) TP53MAPTMEN1KMT2AALDH1A1
SCHEMBL7846561 0.82 GRIN1 (0.38) MEN1KMT2AALDH1A1SMN1; SMN2GRIN1
SCHEMBL7847649 0.81 ALDH1A1 (0.32) TP53MEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL8187917 0.80 USP2 (0.38) MAPTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL7847828 0.80 MEN1 (0.33) TP53MAPTMEN1KMT2AALDH1A1
SCHEMBL8338402 0.77
SCHEMBL8484317 0.77 ALDH1A1 (0.30) ALDH1A1

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-5922727-A 1-((SUBSTITUTED)CYCLOALK(EN)YLALKYL)-6-((SUB)PHENYL(CARBONYL, SULFIDE, OR OXO))-2,4-PYRIMIDINEDIONE DERIVATIVES HAVING SUPERIOR ANTIVIRAL ACTIVITIES; HIV SAMJIN PHARMACEUTICAL CO., LTD (KR) 1999-07-13 US disclosed
EP-0827498-A1 NEW ANTIVIRAL SUBSTITUTED PYRIMIDINEDIONE HOMOCARBOCYCLIC NUCLEOSIDE DERIVATIVES AND METHODS FOR THE PREPARATION THEREOF AND COMPOSITIONS CONTAINING THE SAME AS ACTIVE INGREDIENTS Samjin Pharmaceutical Co., Ltd. (KR) 1998-03-11 EP disclosed
WO-1997030979-A1 NEW ANTIVIRAL SUBSTITUTED PYRIMIDINEDIONE HOMOCARBOCYCLIC NUCLEOSIDE DERIVATIVES AND METHODS FOR THE PREPARATION THEREOF AND COMPOSITIONS CONTAINING THE SAME AS ACTIVE INGREDIENTS SAMJIN PHARMACEUTICAL CO., LTD. (KR) 1997-08-28 WO disclosed