SCHEMBL7845972

SCHEMBL7845972

CCOC(=O)C1(C2Cc3cc(C(=O)NCc4ccccc4)ccc3C2=O)N=CC=N1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.44
LMNA P02545 4/20 0.44
MEN1 O00255 1/20 0.44
GAA P10253 1/20 0.44
TSHR P16473 1/20 0.44
KMT2A Q03164 1/20 0.44
HPGD P15428 2/20 0.43
ROCK2 O75116 2/20 0.42
ROCK1 Q13464 2/20 0.42
EPHX2 P34913 1/20 0.41
PPARG P37231 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
MAPK1 P28482 2/20 0.41
DDB1 Q16531 1/20 0.40
CRBN Q96SW2 1/20 0.40
ADORA3 P0DMS8 1/20 0.40
ADORA2A P29274 1/20 0.40
ADORA2B P29275 1/20 0.40
ADORA1 P30542 1/20 0.40
MAPT P10636 1/20 0.39

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
SCHEMBL7847789 0.87 SMN1; SMN2 (0.41) ALDH1A1MEN1GAAKMT2AEPHX2
SCHEMBL7844391 0.81 CREBBP (0.41) ALDH1A1LMNAMEN1GAAKMT2A
SCHEMBL7845652 0.73 ALDH1A1 (0.53) ALDH1A1MEN1GAATSHRKMT2A
SCHEMBL7845975 0.72 ROCK2 (0.43) ALDH1A1LMNAMEN1GAATSHR
SCHEMBL7835902 0.70 F2R (0.40) ALDH1A1MEN1GAATSHRKMT2A
SCHEMBL7846408 0.67 PKM (0.34) ALDH1A1LMNAGAAHPGDMAPT
SCHEMBL7844926 0.66 ALDH1A1 (0.57) ALDH1A1LMNAMEN1GAATSHR
SCHEMBL6841880 0.64 ALDH1A1 (0.68) ALDH1A1MEN1GAATSHRKMT2A
SCHEMBL20657110 0.64 ALDH1A1 (0.61) ALDH1A1LMNAMEN1GAATSHR
SCHEMBL178366 0.63 MAPK14 (0.75) ALDH1A1LMNAMEN1TSHRKMT2A

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0820455-B1 5H, 10H-IMIDAZO [1,2-a]INDENO [1,2-e]PYRAZIN-4-ONE DERIVATIVES, PREPARATION THEREOF, AND DRUGS CONTAINING SAID DERIVATIVES AVENTIS PHARMA SA (FR) 2001-10-31 EP disclosed
US-6057454-A USEFUL FOR TREATING OR PREVENTING ALL ISCHAEMIAS (SUCH AS FOCAL OR GLOBAL ISCHAEMIA) RESULTING FROM CEREBROVASCULAR DISORDERS RHONE-POULENC RORER S.A. (FR) 2000-05-02 US disclosed
US-5902803-A 5H,10H-imidazo 1,2-a!indeno 1,2-e!pyrazin-4-one derivatives, preparation thereof, and drugs containing said derivatives RHONE-POULENC RORER S.A. (FR) 1999-05-11 US disclosed
EP-0820455-A1 5H, 10H-IMIDAZO [1,2-a]INDENO [1,2-e]PYRAZIN-4-ONE DERIVATIVES, PREPARATION THEREOF, AND DRUGS CONTAINING SAID DERIVATIVES Aventis Pharma S.A. (FR) 1998-01-28 EP disclosed
WO-1996031511-A1 5H,10H-IMIDAZO[1,2-a]INDENO[1,2-e]PYRAZIN-4-ONE DERIVATIVES, PREPARATION THEREOF, AND DRUGS CONTAINING SAID DERIVATIVES RHONE-POULENC RORER S.A. (FR) 1996-10-10 WO disclosed