SCHEMBL19916959

SCHEMBL19916959

C=Cc1c(CC)oc2c3ccccc3c3ccccc3c12

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PBRM1 Q86U86 3/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
CYP2C19 P33261 1/20 0.33
APAF1 O14727 1/20 0.32
NSD2 O96028 1/20 0.32
KDM4C Q9H3R0 1/20 0.32
ESR2 Q92731 1/20 0.31
SLC22A12 Q96S37 1/20 0.31
EYA3 Q99504 1/20 0.31

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
SCHEMBL20352558 0.74 EYA3 (0.45) MEN1KMT2ACYP2C19SLC22A12EYA3
SCHEMBL18080844 0.73 PRKDC (0.36) CYP2C19
SCHEMBL8762701 0.65 EYA3 (0.41) PBRM1MEN1KMT2ACYP2C19SLC22A12
SCHEMBL18931271 0.64 ALDH1A1 (0.43) MEN1KMT2A
SCHEMBL18627735 0.64 ALDH1A1 (0.37)
SCHEMBL25052845 0.64 PGR (0.38) MEN1KMT2A
SCHEMBL19917010 0.63
SCHEMBL24250157 0.63 PTPN1 (0.37) MEN1KMT2ACYP2C19SLC22A12
SCHEMBL23183282 0.62 L3MBTL1 (0.39) MEN1KMT2A
SCHEMBL719026 0.62 EYA3 (0.48) MEN1KMT2ACYP2C19SLC22A12EYA3

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
WO-2018038464-A1 ORGANIC COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME 주식회사 두산 2018-03-01 WO disclosed