SCHEMBL8066802

SCHEMBL8066802

CCOC(=O)c1nnn(Cc2ccc(OC)cc2)c1C(=O)c1cc(OC(C)C)c(OC)cc1N

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.46
MAPT P10636 3/20 0.46
HSD17B10 Q99714 5/20 0.44
ALDH1A1 P00352 4/20 0.44
HPGD P15428 4/20 0.44
KDM4E B2RXH2 3/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
RECQL P46063 1/20 0.43
MEN1 O00255 5/20 0.43
KMT2A Q03164 5/20 0.43
SLC5A1 P13866 1/20 0.43
SLC5A2 P31639 1/20 0.43
RXFP1 Q9HBX9 1/20 0.42
ALOX15 P16050 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
CYP19A1 P11511 3/20 0.41
AKR1C3 P42330 2/20 0.39
TSHR P16473 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
SCHEMBL8057631 1.00 POLB (0.46) POLBMAPTHSD17B10ALDH1A1HPGD
SCHEMBL8057862 0.93 HSD17B10 (0.44) POLBMAPTHSD17B10ALDH1A1HPGD
SCHEMBL8071978 0.93 HSD17B10 (0.44) POLBMAPTHSD17B10ALDH1A1HPGD
SCHEMBL8057540 0.92 HSD17B10 (0.44) POLBMAPTHSD17B10ALDH1A1HPGD
SCHEMBL5508781 0.88 SLC5A1 (0.41) POLBMAPTHSD17B10ALDH1A1HPGD
SCHEMBL8073571 0.88 SLC5A1 (0.41) POLBMAPTHSD17B10ALDH1A1HPGD
SCHEMBL8071738 0.86 ALDH1A1 (0.41) POLBMAPTHSD17B10ALDH1A1HPGD
SCHEMBL7831300 0.83 SMN1; SMN2 (0.48) POLBMAPTHSD17B10ALDH1A1HPGD
SCHEMBL8066745 0.83 POLB (0.44) POLBMAPTHSD17B10ALDH1A1HPGD
SCHEMBL8066864 0.83 POLB (0.49) POLBMAPTHSD17B10ALDH1A1HPGD

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