SCHEMBL8069019

SCHEMBL8069019

COC(=O)c1cc2c(s1)CCN(C(=O)CCc1ccc3c(=O)c4[nH]nnc4c(=O)[nH]c3c1)C2

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 2/20 0.39
WDR77 Q9BQA1 2/20 0.39
HDAC6 Q9UBN7 7/20 0.36
ENPP2 Q13822 4/20 0.33
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 2/20 0.33
HSD17B10 Q99714 2/20 0.33
GLA P06280 1/20 0.33
GAA P10253 1/20 0.33
HPGD P15428 1/20 0.33
KDM1A O60341 5/20 0.33
PARP1 P09874 2/20 0.33
TNK2 Q07912 2/20 0.33
TNK1 Q13470 2/20 0.33
HDAC1 Q13547 1/20 0.32
F2 P00734 1/20 0.32
TPSAB1 Q15661 1/20 0.32
TPSD1 Q9BZJ3 1/20 0.32
TPSG1 Q9NRR2 1/20 0.32
PDE3B Q13370 1/20 0.31

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
SCHEMBL8066729 0.82 MAPK1 (0.47) ENPP2KDM4EALDH1A1HSD17B10GAA
SCHEMBL8069021 0.81 PRMT5 (0.40) PRMT5WDR77HDAC6ENPP2KDM4E
SCHEMBL8068924 0.80 PARP1 (0.38) ALDH1A1HSD17B10PARP1PDE3BPDE3A
SCHEMBL7831864 0.76 KDM4E (0.40) KDM4EALDH1A1HSD17B10GAAHPGD
SCHEMBL7822908 0.73 KDM4E (0.38) KDM4EALDH1A1HSD17B10HPGDPARP1
SCHEMBL7817176 0.69 PARP1 (0.55) KDM4EALDH1A1HSD17B10GLAGAA
SCHEMBL7826505 0.69 PTGES (0.47) ALDH1A1HSD17B10HPGDPARP1
SCHEMBL7825628 0.69 PTGES (0.46) KDM4EALDH1A1
SCHEMBL8073368 0.67 ALDH1A1 (0.43) KDM4EALDH1A1HSD17B10GAAHPGD
SCHEMBL7815301 0.67 KDM4E (0.42) HDAC6KDM4EALDH1A1PARP1HDAC1

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