SCHEMBL21710480

SCHEMBL21710480

CC(C)c1ccc(-c2ccc3c(c2)c2cc4ccccc4c4c5cc(-c6cccc7c6cc6c8cc(-c9ccccc9-c9ccccc9)ccc8n8c9ccccc9c7c68)ccc5n3c24)cc1

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NTSR1 P30989 2/20 0.32
TSPO P30536 1/20 0.31
CA12 O43570 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CA9 Q16790 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
SCHEMBL21710662 0.97 NTSR1 (0.32) NTSR1TSPO
SCHEMBL21718110 0.87 PIK3CD (0.35) TSPO
SCHEMBL22858285 0.85 PIK3CD (0.35) TSPO
SCHEMBL21710466 0.84 NTSR1 (0.32) NTSR1TSPO
SCHEMBL22679811 0.84 KDM4E (0.36) TSPO
SCHEMBL21710691 0.83 NTSR1 (0.33) NTSR1TSPO
SCHEMBL25965152 0.82 TSPO (0.38) TSPOCA12CA1CA2CA9
SCHEMBL21710697 0.82 NTSR1 (0.33) NTSR1CA12CA1CA2CA9
SCHEMBL22858132 0.81 KDM4E (0.36) TSPO
SCHEMBL21717407 0.80 TSPO (0.38) TSPO

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