SCHEMBL8066864

SCHEMBL8066864

CCOC(=O)c1nnn(Cc2ccc(OC)cc2)c1C(=O)c1cc(OC)c(OC)c(OC)c1N

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 4/20 0.49
MAPT P10636 2/20 0.49
HSD17B10 Q99714 4/20 0.47
ALDH1A1 P00352 4/20 0.47
KDM4E B2RXH2 4/20 0.47
HPGD P15428 3/20 0.47
SMN1; SMN2 Q16637 1/20 0.46
RECQL P46063 1/20 0.45
RXFP1 Q9HBX9 1/20 0.44
ALOX15 P16050 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
MEN1 O00255 5/20 0.43
KMT2A Q03164 5/20 0.43
CYP19A1 P11511 2/20 0.42
SLC5A1 P13866 1/20 0.41
SLC5A2 P31639 1/20 0.41
UCHL1 P09936 1/20 0.41
PDE8B O95263 1/20 0.41
ATM Q13315 1/20 0.41
TSHR P16473 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
SCHEMBL8066995 0.93 HSD17B10 (0.47) POLBMAPTHSD17B10ALDH1A1KDM4E
SCHEMBL8066750 0.88 PKM (0.42) POLBMAPTHSD17B10ALDH1A1KDM4E
SCHEMBL8067017 0.85 SMN1; SMN2 (0.48) POLBMAPTHSD17B10ALDH1A1KDM4E
SCHEMBL8057631 0.83 POLB (0.46) POLBMAPTHSD17B10ALDH1A1KDM4E
SCHEMBL8066802 0.83 POLB (0.46) POLBMAPTHSD17B10ALDH1A1KDM4E
SCHEMBL7831300 0.83 SMN1; SMN2 (0.48) POLBMAPTHSD17B10ALDH1A1KDM4E
SCHEMBL5511589 0.82 MAPT (0.44) POLBMAPTHSD17B10ALDH1A1KDM4E
SCHEMBL5518135 0.81 MAPT (0.48) POLBMAPTHSD17B10ALDH1A1KDM4E
SCHEMBL8073468 0.81 PKM (0.42) POLBMAPTHSD17B10ALDH1A1KDM4E
SCHEMBL8066745 0.81 POLB (0.44) POLBMAPTHSD17B10ALDH1A1KDM4E

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