SCHEMBL1422005

SCHEMBL1422005

COc1cc(O)c(CCCc2ccc(OC)c(OC)c2)c(OC)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CALM1 P0DP23 4/20 0.62
PTPN1 P18031 1/20 0.54
NOS2 P35228 1/20 0.54
TUBB4A P04350 1/20 0.51
TUBB P07437 1/20 0.51
TUBA3C P0DPH7 1/20 0.51
TUBA1B P68363 1/20 0.51
TUBA4A P68366 1/20 0.51
TUBB4B P68371 1/20 0.51
TUBB3 Q13509 1/20 0.51
TUBB2A Q13885 1/20 0.51
TUBB8 Q3ZCM7 1/20 0.51
TUBA3E Q6PEY2 1/20 0.51
TUBA1A Q71U36 1/20 0.51
TUBA1C Q9BQE3 1/20 0.51
TUBB6 Q9BUF5 1/20 0.51
TUBB2B Q9BVA1 1/20 0.51
TUBB1 Q9H4B7 1/20 0.51
MEN1 O00255 1/20 0.49
GAA P10253 1/20 0.49

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
SCHEMBL14642751 0.91 ATM (0.54) CALM1MAPTKDM4EATMCYP19A1
SCHEMBL27729799 0.83 CALM1 (0.52) CALM1PTPN1NOS2SLC28A3KDM4E
SCHEMBL14616682 0.80 ATM (0.56) MAPTKDM4EATMCYP19A1
SCHEMBL19545805 0.78 TAAR1 (0.69) CALM1PTPN1NOS2TUBB4ATUBB
SCHEMBL8892042 0.77 CALM1 (0.71) CALM1PTPN1TUBB4ATUBBTUBA3C
SCHEMBL30451939 0.77 CALM1 (0.81) CALM1PTPN1NOS2TUBB4ATUBB
SCHEMBL10343404 0.77 ATM (0.70) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL30869991 0.77 ATM (0.70) TUBB4ATUBBTUBA3CTUBA1BTUBA4A
SCHEMBL23440024 0.76 CYP19A1 (0.67) PTPN1NOS2MEN1GAAMAPT
SCHEMBL30969937 0.76 CYP19A1 (0.67) PTPN1NOS2MEN1GAAMAPT

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
EP-2297127-A1 CHROMENONE DERIVATIVES USEFUL FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES AxoGlia Therapeutics S.A. (LU) 2011-03-23 EP disclosed
WO-2009130253-A1 CHROMENONE DERIVATIVES USEFUL FOR THE TREATMENT OF NEURODEGENERATIVE DISEASES AXOGLIA THERAPEUTICS S.A. (LU) 2009-10-29 WO disclosed