SCHEMBL9754272

SCHEMBL9754272

CCc1cc(CC)c(Nc2cccc3c2C(=O)c2ccccc2C3=O)c(CC)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 9/20 0.53
▸ MAPK1 P28482 7/20 0.53
▸ SMN1; SMN2 Q16637 5/20 0.53
▸ L3MBTL1 Q9Y468 4/20 0.53
▸ RAB9A P51151 3/20 0.53
▸ EGFR P00533 3/20 0.53
▸ TDP1 Q9NUW8 2/20 0.53
▸ PABPC1 P11940 1/20 0.53
▸ MAOA P21397 1/20 0.48
▸ ALDH1A1 P00352 6/20 0.46
▸ LMNA P02545 4/20 0.46
▸ NPC1 O15118 2/20 0.46
▸ CYP1A2 P05177 2/20 0.46
▸ GNG2 P59768 1/20 0.46
▸ GNB1 P62873 1/20 0.46
▸ HIF1A Q16665 1/20 0.46
▸ MEN1 O00255 5/20 0.43
▸ KMT2A Q03164 5/20 0.43
▸ POLB P06746 2/20 0.43
▸ RAD52 P43351 2/20 0.43

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
SCHEMBL27500709 0.91 MAPT (0.49) MAPTMAPK1SMN1; SMN2L3MBTL1RAB9A
SCHEMBL9176387 0.90 P2RY4 (0.47) MAPTMAPK1SMN1; SMN2L3MBTL1RAB9A
SCHEMBL22476073 0.89 MAPT (0.53) MAPTMAPK1SMN1; SMN2L3MBTL1RAB9A
SCHEMBL6131236 0.88 MAPT (0.58) MAPTMAPK1SMN1; SMN2L3MBTL1RAB9A
SCHEMBL20520540 0.83 MAPT (0.47) MAPTMAPK1SMN1; SMN2L3MBTL1RAB9A
SCHEMBL28261851 0.81 P2RY4 (0.45) MAPTMAPK1SMN1; SMN2L3MBTL1RAB9A
SCHEMBL11049450 0.80 MAPT (0.43) MAPTMAPK1SMN1; SMN2L3MBTL1RAB9A
SCHEMBL2612591 0.79 CLCN2 (0.50) MAPTMAPK1SMN1; SMN2L3MBTL1RAB9A
SCHEMBL27475572 0.79 MAPT (0.44) MAPTMAPK1SMN1; SMN2L3MBTL1RAB9A
SCHEMBL414712 0.78 MEN1 (0.50) MAPTMAPK1SMN1; SMN2L3MBTL1RAB9A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-55005952-A — — None — — JP disclosed
WO-1991015954-A1 ANTHRAQUINONES AS INHIBITORS OF SULFIDE PRODUCTION FROM SULFATE-REDUCING BACTERIA E.I. DU PONT DE NEMOURS AND COMPANY (US) 1991-10-31 — — WO disclosed
JP-S555952-A PREPARATION OF CONC. DYE COMPOSITION FUJI PHOTO FILM CO LTD 1980-01-17 — — JP disclosed
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