SCHEMBL9596541

SCHEMBL9596541

O=C1CCc2c(O)cncc2N1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP11B1 P15538 7/20 0.42
▸ CYP11B2 P19099 7/20 0.42
▸ CYP19A1 P11511 4/20 0.42
▸ NPC1 O15118 1/20 0.36
▸ MAPK13 O15264 1/20 0.36
▸ MAPK12 P53778 1/20 0.36
▸ MAPK11 Q15759 1/20 0.36
▸ MAPK14 Q16539 1/20 0.36
▸ CRBN Q96SW2 5/20 0.36
▸ CYP1A2 P05177 2/20 0.35
▸ CYP2C9 P11712 2/20 0.35
▸ TBXAS1 P24557 2/20 0.35
▸ PDE3B Q13370 2/20 0.35
▸ PDE3A Q14432 2/20 0.35
▸ MAPT P10636 1/20 0.34
▸ CYP2C19 P33261 2/20 0.34
▸ CYP2D6 P10635 1/20 0.34
▸ CYP2B6 P20813 1/20 0.34
▸ CA9 Q16790 1/20 0.33
▸ MEN1 O00255 1/20 0.31

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
SCHEMBL14494395 0.78 CYP11B2 (0.38) CYP11B1CYP11B2CYP19A1NPC1MAPK13
SCHEMBL29050349 0.74 CYP11B1 (0.44) CYP11B1CYP11B2CYP19A1NPC1MAPK13
SCHEMBL22753803 0.73 CYP2C19 (0.44) CYP11B1CYP11B2NPC1MAPK13MAPK12
SCHEMBL22311512 0.73 PDE3B (0.37) CYP11B1CYP11B2CYP19A1NPC1MAPK13
SCHEMBL17543775 0.73 SRD5A1 (0.36) CYP11B1CYP11B2CYP19A1NPC1MAPK13
SCHEMBL98299 0.72 NPC1 (0.50) CYP11B1CYP11B2CYP19A1NPC1MAPK13
SCHEMBL29863302 0.72 NPC1 (0.50) CYP11B1CYP11B2CYP19A1NPC1MAPK13
SCHEMBL30731334 0.68 NPC1 (0.37) CYP11B1CYP11B2CYP19A1NPC1MAPK13
SCHEMBL6407953 0.66 MAPT (0.53) CYP11B1CYP11B2CYP19A1NPC1MAPK13
SCHEMBL2233749 0.64 NPC1 (0.55) CYP11B1CYP11B2CYP19A1NPC1MAPK13

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5260177-A Cyan dye-forming coupler, pivaloylacetoanilide yellow coupler, pyrazoloazole magenta coupler FUJI PHOTO FILM CO., LTD. (JP) 1993-11-09 — — US disclosed
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