SCHEMBL8073487

SCHEMBL8073487

CC(=O)Nc1ccc2c(=O)c3[nH]nnc3c(=O)[nH]c2c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.55
ERCC1 P07992 2/20 0.51
FEN1 P39748 2/20 0.51
ERCC4 Q92889 2/20 0.51
CHEK1 O14757 1/20 0.48
KIF11 P52732 1/20 0.45
POLB P06746 1/20 0.43
MAPT P10636 1/20 0.43
BLM P54132 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
DNASE1 P24855 1/20 0.43
KDM4E B2RXH2 3/20 0.41
ALDH1A1 P00352 3/20 0.41
HPGD P15428 3/20 0.41
ESR1 P03372 1/20 0.41
TERT O14746 3/20 0.41
MTNR1A P48039 2/20 0.40
MTNR1B P49286 2/20 0.40
ROCK2 O75116 1/20 0.40
ROCK1 Q13464 1/20 0.40

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
SCHEMBL7831194 0.85 MAPT (0.58) POLBMAPTKDM4EALDH1A1HPGD
SCHEMBL7826265 0.84 CSNK2A1 (0.41) MAOAKIF11KDM4EKMT2A
SCHEMBL7815301 0.81 KDM4E (0.42) MAOAMAPTTDP1KDM4EALDH1A1
SCHEMBL7817176 0.79 PARP1 (0.55) KIF11POLBKDM4EALDH1A1HPGD
SCHEMBL7827947 0.78 PTGES (0.43) CHEK1KIF11POLBKDM4EALDH1A1
SCHEMBL7831634 0.78 GAA (0.42) CHEK1POLBTDP1KDM4EALDH1A1
SCHEMBL7822908 0.77 KDM4E (0.38) MAOAPOLBMAPTKDM4EALDH1A1
SCHEMBL7822903 0.77 IAPP (0.38) MAOACHEK1TDP1
SCHEMBL7826811 0.76 ALDH1A1 (0.40) MAOAPOLBMAPTKDM4EALDH1A1
SCHEMBL8073271 0.76 PARP1 (0.50) CHEK1KIF11MAPTBLMTDP1

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
US-6093714-A AN ANTIALLERGENS FOR TREATMENT AND PREVENTION OF BRONCHIAL ASTHMA, ECZEMA, HIVES, ALLERGIC GASTROINTESTINAL TROUBLES, ALLERGIC RHINITIS, ALLERGIC CONJUNCTIVITIS MEIJI SEIKA KAISHA, LTD. (JP) 2000-07-25 US disclosed
EP-0834512-A1 TRICYCLIC BENZAZEPINE COMPOUNDS MEIJI SEIKA KAISHA LTD. (JP) 1998-04-08 EP disclosed