SCHEMBL21710484

SCHEMBL21710484

CC(C)(C)c1ccc2c(c1)c1cc3c(-c4ccc5c(c4)c4c6ccccc6cc6c7cc(-c8c9ccccc9c(-c9ccccc9)c9ccccc89)ccc7n5c64)cccc3c3c4ccccc4n2c13

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.33
DNMT1 P26358 3/20 0.31
SERPINE1 P05121 1/20 0.30
PPARG P37231 1/20 0.30
PPARA Q07869 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
SCHEMBL21710581 0.83 PPARG (0.33) GPR84DNMT1PPARGPPARA
SCHEMBL21717839 0.82 ESR1 (0.38) GPR84
SCHEMBL21717835 0.81 KIF11 (0.39) GPR84DNMT1
SCHEMBL21710583 0.81 PPARG (0.32) GPR84DNMT1SERPINE1PPARGPPARA
SCHEMBL22858284 0.80 ESR1 (0.38) GPR84
SCHEMBL21718086 0.80 KIF11 (0.38) GPR84DNMT1
SCHEMBL21710662 0.80 NTSR1 (0.32)
SCHEMBL21710483 0.79 GPR84 (0.37) GPR84SERPINE1
SCHEMBL22679811 0.79 KDM4E (0.36) GPR84
SCHEMBL24601643 0.78 DNMT1 (0.36) GPR84DNMT1SERPINE1PPARGPPARA

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-20200052212-A1 ORGANIC ELECTROLUMINESCENT ELEMENT AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2020-02-13 US disclosed