SCHEMBL8066745

SCHEMBL8066745

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

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.44
MAPT P10636 2/20 0.44
RXFP1 Q9HBX9 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.43
HSD17B10 Q99714 4/20 0.43
ALDH1A1 P00352 4/20 0.43
KDM4E B2RXH2 4/20 0.43
RECQL P46063 1/20 0.43
HPGD P15428 3/20 0.43
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
ALOX15 P16050 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
CYP19A1 P11511 4/20 0.41
PDE8B O95263 1/20 0.41
USP2 O75604 2/20 0.40
GLA P06280 1/20 0.40
GAA P10253 1/20 0.40
MAPK1 P28482 1/20 0.40
CASP1 P29466 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
SCHEMBL8057633 0.93 POLB (0.44) POLBMAPTRXFP1SMN1; SMN2HSD17B10
SCHEMBL8068896 0.88 PDE4A (0.41) POLBMAPTRXFP1SMN1; SMN2HSD17B10
SCHEMBL7831300 0.83 SMN1; SMN2 (0.48) POLBMAPTRXFP1SMN1; SMN2HSD17B10
SCHEMBL8057631 0.83 POLB (0.46) POLBMAPTRXFP1SMN1; SMN2HSD17B10
SCHEMBL8066802 0.83 POLB (0.46) POLBMAPTRXFP1SMN1; SMN2HSD17B10
SCHEMBL7828246 0.82 POLB (0.49) POLBMAPTRXFP1SMN1; SMN2HSD17B10
SCHEMBL8071479 0.81 CYP19A1 (0.54) POLBMAPTRXFP1SMN1; SMN2HSD17B10
SCHEMBL8066781 0.81 UCHL1 (0.41) POLBMAPTRXFP1SMN1; SMN2HSD17B10
SCHEMBL8066864 0.81 POLB (0.49) POLBMAPTRXFP1SMN1; SMN2HSD17B10
SCHEMBL8067017 0.81 SMN1; SMN2 (0.48) POLBMAPTRXFP1SMN1; SMN2HSD17B10

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