SCHEMBL4142994

SCHEMBL4142994

C=COc1c(OC)cc(C2(c3cc(OC)c(OC=C)c(C)c3OC)c3ccccc3-c3ccccc32)c(OC)c1C

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.35
ALDH1A1 P00352 3/20 0.35
MEN1 O00255 1/20 0.35
CRHBP P24387 1/20 0.35
KMT2A Q03164 1/20 0.35
CRHR2 Q13324 1/20 0.35
TUBB1 Q9H4B7 3/20 0.34
TUBB4A P04350 2/20 0.34
TUBB P07437 2/20 0.34
TUBA3C P0DPH7 2/20 0.34
TUBA1B P68363 2/20 0.34
TUBA4A P68366 2/20 0.34
TUBB4B P68371 2/20 0.34
TUBB3 Q13509 2/20 0.34
TUBB2A Q13885 2/20 0.34
TUBB8 Q3ZCM7 2/20 0.34
TUBA3E Q6PEY2 2/20 0.34
TUBA1A Q71U36 2/20 0.34
TUBA1C Q9BQE3 2/20 0.34
TUBB6 Q9BUF5 2/20 0.34

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
SCHEMBL4141404 0.92 ALDH1A1 (0.37) MAPTALDH1A1MEN1CRHBPKMT2A
SCHEMBL4137370 0.84 MEN1 (0.33) MAPTALDH1A1MEN1CRHBPKMT2A
SCHEMBL4125806 0.81 ESR1 (0.33) ESR1ESR2
SCHEMBL4140244 0.81 L3MBTL1 (0.34) MAPTALDH1A1TUBB1PDK2ESR1
SCHEMBL4125740 0.79 PDK2 (0.36) PDK2
SCHEMBL4137497 0.77 ESR1 (0.33) MAPTALDH1A1MEN1KMT2APDK2
SCHEMBL7072257 0.77 PDK2 (0.34) MAPTALDH1A1MEN1KMT2ATUBB1
SCHEMBL4136981 0.75 PARP1 (0.33) MAPTALDH1A1MEN1CRHBPKMT2A
SCHEMBL4131212 0.73 PDK2 (0.34) MAPTALDH1A1TUBB1PDK2SMN1; SMN2
SCHEMBL4140147 0.71 PDK2 (0.37) MAPTPDK2

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-20090068569-A1 Resin composition for hologram recording material, hologram recording material, and method for producing hologram recording medium NIPPON PAINT CO., LTD. 2009-03-12 US disclosed