SCHEMBL11235510

SCHEMBL11235510

CCCCCCCCc1ccc(N(c2ccc(CCCCCCCC)cc2)C2(c3c(C)n(CC)c4ccccc34)OC(=O)c3cccnc32)cc1

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RORA P35398 1/20 0.36
RORC P51449 1/20 0.36
RORB Q92753 1/20 0.36
KAT2B Q92831 1/20 0.33
GSK3A P49840 1/20 0.33
GSK3B P49841 1/20 0.33
PLA2G2A P14555 1/20 0.33
HSD11B1 P28845 2/20 0.32
NPY5R Q15761 1/20 0.32
CTSV O60911 1/20 0.32
CTSL P07711 1/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
POLB P06746 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32

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
SCHEMBL11250433 0.89 RORA (0.36) RORARORCRORBGSK3AGSK3B
SCHEMBL11063409 0.88 RORA (0.38) RORARORCRORBPLA2G2ACTSV
SCHEMBL11242383 0.88 GSK3A (0.38) GSK3AGSK3BNPY5RMEN1KMT2A
SCHEMBL11245349 0.88 GSK3A (0.36) RORARORCRORBKAT2BGSK3A
SCHEMBL11245671 0.87 ALDH1A1 (0.38) GSK3AGSK3BMEN1KMT2ATDP1
SCHEMBL11232126 0.85 KDM4E (0.37) GSK3AGSK3BMEN1KMT2ATDP1
SCHEMBL11247969 0.83 SMN1; SMN2 (0.39) GSK3AGSK3BPOLB
SCHEMBL11237223 0.83 MAPT (0.35) GSK3AGSK3BMEN1KMT2A
SCHEMBL11067919 0.82 RORA (0.43) RORARORCRORBPLA2G2AMEN1
SCHEMBL29044637 0.81 GSK3A (0.40) GSK3AGSK3BNPY5RMEN1KMT2A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4211872-A COLOR FORMERS FREEDOM CHEMICAL COMPANY 1980-07-08 US claimed
US-4337340-A FROM DIPHENYLAMINES AND BENZOYL OR 3-INDOLYLCARBONYL PYRIDINE- OR PYRAZINECARBOXYLIC ACIDS STERLING DRUG INC. (US) 1982-06-29 US disclosed
US-4243250-A FUROPYRIDINONES OR FUROPYRAZINONES AS COLOR FORMERS STERLING DRUG INC. (US) 1981-01-06 US disclosed
US-4211872-A COLOR FORMERS FREEDOM CHEMICAL COMPANY 1980-07-08 US disclosed