SCHEMBL17811610

SCHEMBL17811610

CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccccc4-c4ccc(N(c5ccc6c(c5)C(C)(C)c5ccccc5-6)c5ccc(-c6ccccc6)c6ccccc56)cc4)cc3)c3ccc(-c4ccccc4)c4ccccc34)cc21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 1/20 0.38
RXRB P28702 1/20 0.38
PDK2 Q15119 4/20 0.34
RAB9A P51151 1/20 0.31
RCE1 Q9Y256 1/20 0.31
CRHR1 P34998 1/20 0.31
MLNR O43193 1/20 0.30
NR1I2 O75469 1/20 0.30
CHRM2 P08172 1/20 0.30
ADRB1 P08588 1/20 0.30
HTR1A P08908 1/20 0.30
ADRA2A P08913 1/20 0.30
CHRM1 P11229 1/20 0.30
DRD2 P14416 1/20 0.30
ADRA2B P18089 1/20 0.30
ADRA2C P18825 1/20 0.30
CHRM3 P20309 1/20 0.30
DRD1 P21728 1/20 0.30
SLC6A2 P23975 1/20 0.30
HTR2A P28223 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
SCHEMBL13903642 0.97 RXRA (0.38) RXRARXRBPDK2CRHR1MLNR
SCHEMBL13725311 0.96 RXRA (0.37) RXRARXRBPDK2CRHR1
SCHEMBL13374522 0.95 RXRA (0.36) RXRARXRBPDK2CRHR1
SCHEMBL15081588 0.95 RXRA (0.36) RXRARXRBPDK2CRHR1
SCHEMBL15081567 0.95 RXRA (0.36) RXRARXRBPDK2CRHR1
SCHEMBL13374410 0.95 RXRA (0.36) RXRARXRBPDK2CRHR1
SCHEMBL15081596 0.95 RXRA (0.38) RXRARXRBPDK2MLNRNR1I2
SCHEMBL13725731 0.95 RXRA (0.38) RXRARXRBPDK2MLNRNR1I2
SCHEMBL15081532 0.95 RXRA (0.38) RXRARXRBPDK2MLNRNR1I2
SCHEMBL13725670 0.95 RXRA (0.38) RXRARXRBPDK2MLNRNR1I2

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
US-20160163982-A1 ORGANIC ELECTROLUMINESCENT DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-06-09 US disclosed
US-20160163982-A1 ORGANIC ELECTROLUMINESCENT DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2016-06-09 US disclosed