SCHEMBL23299546

SCHEMBL23299546

C1=CCC2C(=C1)c1cc(-c3ccc4c(c3)c3ccccc3n4-c3ccc(-c4ccccc4)cc3)ccc1N2c1cccc2ccccc12

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ TSPO P30536 1/20 0.30
▸ HDAC4 P56524 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
SCHEMBL23618990 0.96 KDM4E (0.32) —
SCHEMBL27344760 0.89 KDM4E (0.30) —
SCHEMBL23618991 0.89 KDM4E (0.32) —
SCHEMBL10283488 0.86 PTGER4 (0.32) TSPO
SCHEMBL23738527 0.86 — —
SCHEMBL24061557 0.85 KDM4E (0.31) —
SCHEMBL25445587 0.85 KDM4E (0.36) TSPOHDAC4
SCHEMBL23738526 0.84 — —
SCHEMBL24382312 0.84 — —
SCHEMBL23299545 0.82 — —

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-2021080368-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME 주식회사 엘지화학 2021-04-29 — — WO disclosed
Send feedback