SCHEMBL7822677

SCHEMBL7822677

CCOC(=O)c1nc(CP(=O)(O)O)c[nH]1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.40
ALDH1A1 P00352 3/20 0.40
HPGD P15428 2/20 0.40
HTT P42858 1/20 0.40
RECQL P46063 1/20 0.40
CYP1A2 P05177 3/20 0.38
PGK1 P00558 1/20 0.38
PGK2 P07205 1/20 0.38
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.35
CYP2C19 P33261 2/20 0.35
POLB P06746 1/20 0.35
GAA P10253 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP3A4 P08684 1/20 0.35
TSHR P16473 1/20 0.34
PDE4D Q08499 1/20 0.34

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
SCHEMBL8012694 0.87 KDM4E (0.39) KDM4EALDH1A1HPGDHTTRECQL
SCHEMBL19358702 0.83 ALDH1A1 (0.45) KDM4EALDH1A1HPGDHTTRECQL
SCHEMBL4704967 0.80 ALDH1A1 (0.46) KDM4EALDH1A1HPGDHTTRECQL
SCHEMBL2423817 0.79 KDM4E (0.47) KDM4EALDH1A1HPGDHTTRECQL
SCHEMBL7846199 0.79 KDM4E (0.42) KDM4EALDH1A1HPGDHTTRECQL
Hydrochloric Acid SCHEMBL5741762 0.79 ALDH1A1 (0.45) KDM4EALDH1A1HPGDHTTRECQL
SCHEMBL8015267 0.79 KMT2A (0.44) KDM4EALDH1A1HPGDHTTRECQL
SCHEMBL5742547 0.75 KDM4E (0.39) KDM4EALDH1A1HPGDHTTRECQL
SCHEMBL20477417 0.75 SMN1; SMN2 (0.56) KDM4EALDH1A1HPGDCYP1A2MEN1
SCHEMBL8015619 0.75 KDM4E (0.41) KDM4EALDH1A1HPGDHTTRECQL

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-0880522-B1 5H,10H-IMIDAZO[1,2-a]INDENO[1,2-e]PYRAZINE-4-ONE DERIVATIVES AMPA AND NMDA RECEPTORS ANTAGONISTS, PREPARATION THEREOF, INTERMEDIATES THEREOF AND DRUGS CONTAINING SAME AVENTIS PHARMA SA (FR) 2001-09-19 EP disclosed
EP-0880522-A1 5H,10H-IMIDAZO 1,2-a]INDENO 1,2-e]PYRAZINE-4-ONE DERIVATIVES, PREPARATION THEREOF, INTERMEDIATES THEREOF AND DRUGS CONTAINING SAME Aventis Pharma S.A. (FR) 1998-12-02 EP disclosed
WO-1997025328-A1 5H,10H-IMIDAZO[1,2-a]INDENO[1,2-e]PYRAZINE-4-ONE DERIVATIVES, PREPARATION THEREOF, INTERMEDIATES THEREOF AND DRUGS CONTAINING SAME RHONE-POULENC RORER S.A. (FR) 1997-07-17 WO disclosed