SCHEMBL7988835

SCHEMBL7988835

CCOC(=O)Cn1cc2c(n1)CCN(C(=O)[C@H](C)NC(=O)OC(C)(C)C)C2

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.42
GAA P10253 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
ADORA1 P30542 2/20 0.39
ALDH1A1 P00352 2/20 0.39
ATM Q13315 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ITGB3 P05106 1/20 0.38
ITGA2B P08514 1/20 0.38
CTSK P43235 1/20 0.38
TSHR P16473 1/20 0.37
HRH2 P25021 2/20 0.37
HRH1 P35367 2/20 0.37
CTSL P07711 1/20 0.36
ENPP2 Q13822 1/20 0.35
MAPK1 P28482 2/20 0.35
LMNA P02545 1/20 0.35
TDP1 Q9NUW8 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
SCHEMBL7986455 0.90 ADORA1 (0.43) KMT2AGAAL3MBTL1ADORA1ALDH1A1
SCHEMBL7992678 0.89 ITGB3 (0.45) KMT2AGAAL3MBTL1ALDH1A1ATM
SCHEMBL7974848 0.86 ADORA1 (0.56) KMT2AADORA1ITGB3ITGA2BCTSK
SCHEMBL7989135 0.85 ADORA1 (0.48) KMT2AADORA1ITGB3ITGA2BHRH2
SCHEMBL7988287 0.85 ADORA1 (0.48) KMT2AADORA1ITGB3ITGA2BCTSK
SCHEMBL7988759 0.84 KMT2A (0.50) KMT2AGAAL3MBTL1ADORA1ALDH1A1
SCHEMBL7988765 0.83 ADORA1 (0.46) KMT2AADORA1ITGB3ITGA2BCTSK
SCHEMBL7988313 0.82 ITGB3 (0.59) KMT2AADORA1SMN1; SMN2ITGB3ITGA2B
SCHEMBL7986328 0.81 ITGB3 (0.39) KMT2AGAAL3MBTL1ADORA1ALDH1A1
SCHEMBL7986333 0.81 ITGB3 (0.39) KMT2AGAAL3MBTL1ADORA1ALDH1A1

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
US-5492792-A OPTICAL CARD OR DISKS; EXCELLENT LIGHT SENSITIVITY WITHIN NEAR INFRARED REGION AND HEAT RESISTANCE; STORE INFORMATIONSAT HIGH DENSITY CANON KABUSHIKI KAISHA (JP) 1996-02-20 US claimed
US-6265418-B1 ANTICOAGULANTS UBE INDUSTRIES, LTD. (JP) 2001-07-24 US disclosed
EP-1020467-A1 N-ACYLAMINO ACID AMIDE COMPOUNDS AND INTERMEDIATES FOR PREPARATION THEREOF UBE INDUSTRIES LIMITED (JP) 2000-07-19 EP disclosed
US-5492792-A OPTICAL CARD OR DISKS; EXCELLENT LIGHT SENSITIVITY WITHIN NEAR INFRARED REGION AND HEAT RESISTANCE; STORE INFORMATIONSAT HIGH DENSITY CANON KABUSHIKI KAISHA (JP) 1996-02-20 US disclosed
US-5482822-A MULTILAYER ELEMENT FOR OPTICAL DISKS WITH SUBSTRATE AND OPTICAL COATINGS CANON KABUSHIKI KAISHA (JP) 1996-01-09 US disclosed