SCHEMBL9007487

SCHEMBL9007487

Cc1c(OCc2ccccc2)ccc(OCc2ccccc2)c1C

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.80
TDP1 Q9NUW8 2/20 0.80
L3MBTL1 Q9Y468 2/20 0.80
MAPK1 P28482 1/20 0.80
SMN1; SMN2 Q16637 2/20 0.60
CYP2C9 P11712 1/20 0.60
CYP2C19 P33261 1/20 0.60
MAPK14 Q16539 2/20 0.56
LIPE Q05469 1/20 0.55
PTPN1 P18031 1/20 0.54
HTR1A P08908 2/20 0.52
DRD2 P14416 1/20 0.52
STAT3 P40763 1/20 0.51
HTT P42858 1/20 0.51
HTR6 P50406 1/20 0.51
FFAR4 Q5NUL3 1/20 0.50
ADRA1D P25100 1/20 0.50
ADRA1A P35348 1/20 0.50
ADRA1B P35368 1/20 0.50
PTGER1 P34995 1/20 0.49

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
Ammonia Solution, Strong SCHEMBL27910258 0.90 MAPT (0.67) MAPTTDP1L3MBTL1MAPK1SMN1; SMN2
SCHEMBL19612191 0.89 MAPT (1.00) MAPTTDP1L3MBTL1MAPK1SMN1; SMN2
SCHEMBL31725934 0.89 MAPT (0.65) MAPTTDP1L3MBTL1MAPK1SMN1; SMN2
SCHEMBL4469014 0.89 MAPT (0.65) MAPTTDP1L3MBTL1MAPK1SMN1; SMN2
SCHEMBL9340084 0.89 MAPT (0.65) MAPTTDP1L3MBTL1MAPK1SMN1; SMN2
SCHEMBL24819317 0.86 MAPT (0.61) MAPTTDP1L3MBTL1MAPK1SMN1; SMN2
SCHEMBL31613048 0.85 MAPT (0.65) MAPTTDP1L3MBTL1MAPK1SMN1; SMN2
SCHEMBL9540402 0.84 L3MBTL1 (0.67) MAPTTDP1L3MBTL1MAPK1SMN1; SMN2
SCHEMBL15668933 0.84 MAPT (0.59) MAPTTDP1L3MBTL1MAPK1SMN1; SMN2
SCHEMBL24968079 0.84 L3MBTL1 (0.63) MAPTTDP1L3MBTL1MAPK1SMN1; SMN2

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-5506361-A ACTS BOTH AS AN ANGIOTENSIN II ANTAGONIST AND A LIPIDPEROXIDATION INHIBITOR THEUPJOHN COMPANY (US) 1996-04-09 US disclosed
WO-1992019211-A2 IMIDAZOBENZOQUINONES AND COMPOSITION FOR PREVENTING OR TREATING HYPERTENSION OR CONGESTIVE HEART FAILURE CONTAINING THE SAME THE UPJOHN COMPANY (US) 1992-11-12 WO disclosed