SCHEMBL27934835

SCHEMBL27934835

COc1[c]cc(OC)c(O)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.41
MAPT P10636 2/20 0.41
ALOX15 P16050 1/20 0.39
ALOX12 P18054 1/20 0.39
MAOB P27338 1/20 0.39
TDP1 Q9NUW8 1/20 0.38
TUBB1 Q9H4B7 9/20 0.38
TUBB4A P04350 8/20 0.38
TUBB P07437 8/20 0.38
TUBA3C P0DPH7 8/20 0.38
TUBA1B P68363 8/20 0.38
TUBA4A P68366 8/20 0.38
TUBB4B P68371 8/20 0.38
TUBB3 Q13509 8/20 0.38
TUBB2A Q13885 8/20 0.38
TUBB8 Q3ZCM7 8/20 0.38
TUBA3E Q6PEY2 8/20 0.38
TUBA1A Q71U36 8/20 0.38
TUBA1C Q9BQE3 8/20 0.38
TUBB6 Q9BUF5 8/20 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
SCHEMBL28093164 0.80 MAOB (0.40) CYP3A4MAPTALOX15ALOX12MAOB
SCHEMBL592705 0.79 CYP3A4 (0.39) CYP3A4MAPTTDP1ALDH1A1CA1
SCHEMBL931551 0.78 TDP1 (0.38) CYP3A4MAPTALOX15ALOX12MAOB
SCHEMBL25182107 0.77 EP300 (0.39) CYP3A4MAPTALOX15ALOX12MAOB
SCHEMBL15475102 0.77 ALOX5 (0.39) CYP3A4MAPTALOX15ALOX12MAOB
SCHEMBL1969378 0.76 ACHE (0.39) CYP3A4MAPTTUBB1
SCHEMBL11358289 0.74 POLB (0.39) MAPTALOX15ALOX12TUBB1ALDH1A1
SCHEMBL28188574 0.74 LMNA (0.36) CYP3A4MAPTTUBB1MAPK1
SCHEMBL219318 0.74 GAA (0.42) MAPTALOX12TDP1ALDH1A1TP53
SCHEMBL28176258 0.74 HTR2A (0.34) CYP3A4MAPTTSHRCYP1A2

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
CN-103539722-A Aryl-substituted methyl-connected bis-indoleacetic acid derivative and preparation method and application thereof UNIVISION PHARMACEUTICAL CO LTD 2014-01-29 CN disclosed