Sugi Predict

Sugi Predict / Compounds / SCHEMBL22706267

SCHEMBL22706267

SCHEMBL22706267

c1ccc(-c2c3cccc(-c4cccc5c4-c4ccccc4C54c5ccccc5Oc5ccccc54)c3cc3c(-c4cccc5c4-c4ccccc4C54c5ccccc5Oc5ccccc54)cccc23)cc1

nearest known ligand 0.31

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ GPR84 Q9NQS5 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ CYP2C9 P11712 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ ALOX15 P16050 1/20 0.31
▸ ALOX12 P18054 1/20 0.31
▸ BRCA1 P38398 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.30
▸ MAPK1 P28482 1/20 0.30
▸ ATM Q13315 1/20 0.30
▸ HTT P42858 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
SCHEMBL22707592 0.99 GPR84 (0.31) GPR84ALDH1A1CYP2C9HPGDALOX15
SCHEMBL22706163 0.97 GPR84 (0.30) GPR84ALDH1A1CYP2C9HPGDALOX15
SCHEMBL22706266 0.92 GPR84 (0.33) GPR84
SCHEMBL22706832 0.89 KDM4E (0.35) GPR84ALDH1A1HPGDKDM4EMAPK1
SCHEMBL22706851 0.87 KDM4E (0.33) GPR84KDM4EMAPK1ATM
SCHEMBL22707149 0.86 GPR84 (0.31) GPR84KDM4EMAPK1ATM
SCHEMBL22708198 0.86 KDM4E (0.36) GPR84ALDH1A1HPGDHSD17B10KDM4E
SCHEMBL22708207 0.86 CES1 (0.38) GPR84KDM4EMAPK1ATM
SCHEMBL22706268 0.86 GPR84 (0.31) GPR84
SCHEMBL22707170 0.86 ALOX5 (0.33) KDM4EMAPK1ATM

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
US-20200373496-A1 ORGANIC LIGHT EMITTING ELEMENT LG CHEM, LTD. (KR) 2020-11-26 — — US disclosed