SCHEMBL21741485

SCHEMBL21741485

Cc1cc(C)c(-c2c3ccccc3c(-c3cc4ccccc4c4c3OP(=O)(O)Oc3c(-c5c6ccccc6c(-c6c(C)cc(I)cc6C)c6ccccc56)cc5ccccc5c3-4)c3ccccc23)c(C)c1

nearest known ligand 0.62

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 19/20 0.62
MEN1 O00255 2/20 0.58
KMT2A Q03164 2/20 0.58
KDM4E B2RXH2 1/20 0.58
RECQL P46063 1/20 0.50

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
SCHEMBL21741484 0.94 GPR84 (0.66) GPR84MEN1KMT2AKDM4ERECQL
SCHEMBL296967 0.88 GPR84 (0.74) GPR84MEN1KMT2AKDM4ERECQL
SCHEMBL297729 0.82 GPR84 (0.81) GPR84MEN1KMT2AKDM4ERECQL
SCHEMBL297566 0.82 GPR84 (0.77) GPR84MEN1KMT2AKDM4ERECQL
SCHEMBL14328309 0.81 GPR84 (0.62) GPR84MEN1KMT2AKDM4ERECQL
SCHEMBL296149 0.80 GPR84 (0.82) GPR84MEN1KMT2AKDM4ERECQL
SCHEMBL887435 0.80 GPR84 (0.80) GPR84MEN1KMT2AKDM4ERECQL
SCHEMBL3922363 0.80 GPR84 (0.72) GPR84MEN1KMT2AKDM4ERECQL
SCHEMBL887269 0.78 GPR84 (0.74) GPR84MEN1KMT2AKDM4ERECQL
SCHEMBL25484963 0.77 GPR84 (0.75) GPR84MEN1KMT2AKDM4ERECQL

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-2020037163-A1 POLYVINYL ETHERS AND METHODS RELATED THERETO THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2020-02-20 WO disclosed