SCHEMBL8310274

SCHEMBL8310274

COc1cc(CCN2CC[N]CC2)cc(OC)c1OC

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.49
HTR2A P28223 1/20 0.49
HTR2C P28335 1/20 0.49
HTR2B P41595 1/20 0.49
MEN1 O00255 1/20 0.48
ALDH1A1 P00352 1/20 0.48
KMT2A Q03164 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
AOC3 Q16853 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
TUBB4A P04350 1/20 0.45
TUBB P07437 1/20 0.45
TUBA3C P0DPH7 1/20 0.45
TUBA1B P68363 1/20 0.45
TUBA4A P68366 1/20 0.45
TUBB4B P68371 1/20 0.45
TUBB3 Q13509 1/20 0.45
TUBB2A Q13885 1/20 0.45
TUBB8 Q3ZCM7 1/20 0.45
TUBA3E Q6PEY2 1/20 0.45

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
SCHEMBL11879869 0.89 HTR2A (0.56) KDM4EHTR2AHTR2CHTR2BMEN1
SCHEMBL8308417 0.84 KDM4E (0.67) KDM4EMEN1ALDH1A1KMT2ATDP1
SCHEMBL9397288 0.83 SIGMAR1 (0.63) SIGMAR1EBPTMEM97
SCHEMBL7297538 0.81 SLC6A4 (0.49) KDM4EHTR2AHTR2CHTR2BMEN1
Hydrochloric Acid SCHEMBL9780460 0.80 APOBEC3A (0.50) KDM4EHTR2AHTR2CHTR2BMEN1
SCHEMBL9397184 0.79 SIGMAR1 (0.57) SIGMAR1EBPTMEM97
SCHEMBL1298962 0.76 SIGMAR1 (0.76) SIGMAR1EBPTMEM97
SCHEMBL25634998 0.75 HRH3 (0.51) KDM4EHTR2ASMN1; SMN2SIGMAR1EBP
SCHEMBL14375340 0.75 KDM4E (0.60) KDM4EHTR2AHTR2CHTR2BMEN1
SCHEMBL27690553 0.75 POLB (0.53) KDM4EHTR2ASMN1; SMN2TUBB4ATUBB

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
EP-0903346-A1 SYDNONE IMINE DERIVATIVES Chugai Seiyaku Kabushiki Kaisha (JP) 1999-03-24 EP disclosed