SCHEMBL11245349

SCHEMBL11245349

CCCCCCCCc1ccc(N(c2ccc(CCCCCCCC)cc2)C2(c3c(C)n(CC)c4ccccc34)OC(=O)c3ncccc32)cc1

nearest known ligand 0.36

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GSK3A P49840 1/20 0.36
GSK3B P49841 1/20 0.36
RORA P35398 1/20 0.35
RORC P51449 1/20 0.35
RORB Q92753 1/20 0.35
KAT2B Q92831 1/20 0.33
PLA2G2A P14555 1/20 0.33
CNR2 P34972 5/20 0.32
NPY5R Q15761 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
HPGD P15428 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
SCHEMBL11250433 0.90 RORA (0.36) GSK3AGSK3BRORARORCRORB
SCHEMBL11239203 0.88 GSK3A (0.42) GSK3AGSK3BNPY5RMEN1KMT2A
SCHEMBL11235510 0.88 RORA (0.36) GSK3AGSK3BRORARORCRORB
SCHEMBL11063409 0.87 RORA (0.38) RORARORCRORBPLA2G2ACNR2
SCHEMBL11067919 0.81 RORA (0.43) RORARORCRORBPLA2G2ACNR2
SCHEMBL11058958 0.78 RORA (0.36) RORARORCRORBCNR2MEN1
SCHEMBL11244452 0.77 TRPV1 (0.36) KAT2BCNR2KMT2AALDH1A1HPGD
SCHEMBL11236537 0.77 GSK3A (0.39) GSK3AGSK3BMEN1KMT2AKDM4E
SCHEMBL11237151 0.75 LMNA (0.32) CNR2LMNA
SCHEMBL1617814 0.75 GSK3A (0.44) 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