SCHEMBL27500281

SCHEMBL27500281

COc1cccc(OC)c1[P](=O)C(=O)c1c(C)cc(C(=O)c2ccccc2)c(C)c1C

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 9/20 0.43
▸ LMNA P02545 6/20 0.43
▸ HPGD P15428 3/20 0.43
▸ KDM4E B2RXH2 2/20 0.43
▸ HSD17B10 Q99714 2/20 0.43
▸ CYP3A4 P08684 1/20 0.43
▸ RECQL P46063 1/20 0.43
▸ TP53 P04637 1/20 0.41
▸ GAA P10253 1/20 0.41
▸ MAPK1 P28482 3/20 0.41
▸ ALOX15 P16050 1/20 0.41
▸ SMN1; SMN2 Q16637 3/20 0.39
▸ KMT2A Q03164 3/20 0.39
▸ RAB9A P51151 3/20 0.39
▸ NPC1 O15118 2/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ HTT P42858 3/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ ALDH1A1 P00352 3/20 0.39
▸ CYP1A2 P05177 2/20 0.38

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
SCHEMBL27484933 0.92 MAPT (0.42) MAPTLMNAHPGDKDM4EHSD17B10
SCHEMBL27485658 0.89 RAB9A (0.41) MAPTLMNAHPGDKDM4EHSD17B10
SCHEMBL27561239 0.87 MAPT (0.45) MAPTLMNAHPGDKDM4EHSD17B10
SCHEMBL27484262 0.81 MAPT (0.39) MAPTLMNAHPGDKDM4EHSD17B10
SCHEMBL27498758 0.81 MAPT (0.42) MAPTLMNAHPGDKDM4EHSD17B10
SCHEMBL27500272 0.81 LMNA (0.45) MAPTLMNAHPGDKDM4EHSD17B10
SCHEMBL27500969 0.74 HPGD (0.42) MAPTLMNAHPGDKDM4EHSD17B10
SCHEMBL27483932 0.73 CYP2C9 (0.33) LMNAHPGDKDM4EHSD17B10CYP3A4
SCHEMBL7188418 0.72 MAPT (0.43) MAPTLMNAHPGDKDM4EHSD17B10
SCHEMBL3894224 0.71 MAPT (0.59) MAPTLMNAHPGDKDM4EHSD17B10

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
CN-1200943-C Organometallic acyl-aryl phosphine CIBA SC HOLDING AG (CH) 2005-05-11 — — CN disclosed
CN-1308081-A Organometallic acyl-aryl phosphine CIBA SC HOLDING AG (CH) 2001-08-15 — — CN disclosed
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