SCHEMBL16614181

SCHEMBL16614181

Brc1ccc(C2(c3ccccc3)c3ccccc3-c3c2ccc2c3oc3ccccc32)cc1

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PGR P06401 1/20 0.35
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 1/20 0.34
LMNA P02545 1/20 0.34
MAPT P10636 1/20 0.34
OPRK1 P41145 1/20 0.34
KMT2A Q03164 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
ALOX5 P09917 2/20 0.33
TNKS O95271 1/20 0.32
ESR1 P03372 1/20 0.30
ESR2 Q92731 1/20 0.30
OPRM1 P35372 1/20 0.30
OPRD1 P41143 1/20 0.30

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
SCHEMBL18382952 0.92 PGR (0.39) PGRKDM4EMEN1LMNAMAPT
SCHEMBL30818204 0.92 PGR (0.39) PGRKDM4EMEN1LMNAMAPT
SCHEMBL16614124 0.90 ALOX5 (0.36) PGRALOX5ESR1ESR2OPRM1
SCHEMBL18904400 0.86 PGR (0.34) PGRKDM4EMEN1LMNAMAPT
SCHEMBL16614179 0.86 KDM4E (0.36) PGRKDM4EMEN1LMNAMAPT
SCHEMBL17879495 0.85 ALOX5 (0.40) PGRKDM4EMEN1MAPTKMT2A
SCHEMBL16491813 0.84 ALOX5 (0.39) PGRKDM4EMEN1MAPTKMT2A
SCHEMBL20127191 0.84 ALDH1A1 (0.36) PGRKDM4EMEN1LMNAMAPT
SCHEMBL16232653 0.83 ALOX5 (0.39) PGRKDM4EMEN1MAPTKMT2A
SCHEMBL15990196 0.83 ALOX5 (0.39) PGRKDM4EMEN1MAPTKMT2A

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-2015046955-A1 NOVEL ORGANIC ELECTROLUMINESCENT COMPOUND AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING THE SAME ROHM AND HAAS ELECTRONIC MATERIALS KOREA LTD. (KR) 2015-04-02 WO disclosed