SCHEMBL30971017

SCHEMBL30971017

OCCOc1c(-c2ccc3ccccc3c2)cc2ccccc2c1-c1c(OCCO)c(-c2ccc3ccccc3c2)cc2ccccc12

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 10/20 0.49
HDAC4 P56524 1/20 0.41
HDAC2 Q92769 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
GSTP1 P09211 1/20 0.40
IDO1 P14902 1/20 0.39
ALDH1A1 P00352 1/20 0.39
RECQL P46063 1/20 0.39
SLC6A2 P23975 1/20 0.38
SLC6A4 P31645 1/20 0.38
SLC6A3 Q01959 1/20 0.38
KDM4E B2RXH2 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
ESR1 P03372 1/20 0.37
ESR2 Q92731 1/20 0.37
ALOX5 P09917 2/20 0.36
DHFR P00374 1/20 0.36

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
SCHEMBL29127412 0.91 GPR84 (0.44) GPR84HDAC4HDAC2HDAC8GSTP1
SCHEMBL29506852 0.88 GPR84 (0.48) GPR84IDO1ALDH1A1RECQLKDM4E
SCHEMBL22187663 0.88 GPR84 (0.48) GPR84IDO1ALDH1A1RECQLKDM4E
SCHEMBL31443087 0.84 ALOX5 (0.45) GPR84HDAC4HDAC2HDAC8GSTP1
SCHEMBL31094274 0.84 CYP11B1 (0.41) GPR84IDO1ALDH1A1RECQLKDM4E
SCHEMBL30292776 0.83 GSTP1 (0.46) HDAC4HDAC2HDAC8GSTP1ALDH1A1
SCHEMBL31443146 0.83 IDO1 (0.43) GPR84HDAC4HDAC2HDAC8GSTP1
SCHEMBL29601268 0.81 GPR84 (0.45) GPR84HDAC8IDO1ALDH1A1RECQL
SCHEMBL31443149 0.81 ALOX5 (0.42) GPR84HDAC4HDAC2HDAC8GSTP1
SCHEMBL20774067 0.81 GPR84 (0.44) GPR84HDAC4HDAC2HDAC8IDO1

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
CN-113474685-B optical lens 帝人株式会社 2024-05-28 CN disclosed